.ALPHA.-(4-(2-(DIETHYLAMINO)ETHOXY)PHENYL)-.BETA.-ETHYL-4-METHOXY-.ALPHA.-PHENYL BENZENEETHANOL CITRATE (1:1)

Details

Stereochemistry	MIXED
Molecular Formula	C29H37NO3.C6H8O7
Molecular Weight	639.7325
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of .ALPHA.-(4-(2-(DIETHYLAMINO)ETHOXY)PHENYL)-.BETA.-ETHYL-4-METHOXY-.ALPHA.-PHENYL BENZENEETHANOL CITRATE (1:1)

Structure Search

SMILES

OC(=O)CC(O)(CC(O)=O)C(O)=O.CCC(C1=CC=C(OC)C=C1)C(O)(C2=CC=CC=C2)C3=CC=C(OCCN(CC)CC)C=C3

InChI

InChIKey=CMWDHRAFKIMMGG-UHFFFAOYSA-N

InChI=1S/C29H37NO3.C6H8O7/c1-5-28(23-13-17-26(32-4)18-14-23)29(31,24-11-9-8-10-12-24)25-15-19-27(20-16-25)33-22-21-30(6-2)7-3;7-3(8)1-6(13,5(11)12)2-4(9)10/h8-20,28,31H,5-7,21-22H2,1-4H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

HIDE SMILES / InChI

Molecular Formula	C6H8O7
Molecular Weight	192.1235
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Molecular Formula	C29H37NO3
Molecular Weight	447.609
Charge	0
Count

Stereochemistry	MIXED
Additional Stereochemistry	No
Defined Stereocenters	0 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:51:33 GMT 2023` Edited by `admin` on `Sat Dec 16 09:51:33 GMT 2023`
Record UNII	N6220RDT93
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

.ALPHA.-(4-(2-(DIETHYLAMINO)ETHOXY)PHENYL)-.BETA.-ETHYL-4-METHOXY-.ALPHA.-PHENYL BENZENEETHANOL CITRATE (1:1)

Systematic Name

English

PHENETHYL ALCOHOL, ALPHA-(P-(2-(DIETHYLAMINO)ETHOXY)PHENYL)-BETA-ETHYL-P-METHOXY-ALPHA-PHENYL-, CITRATE (1:1)

Common Name

English

BENZENEETHANOL, .ALPHA.-(4-(2-(DIETHYLAMINO)ETHOXY)PHENYL)-.BETA.-ETHYL-4-METHOXY-.ALPHA.-PHENYL-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1)

Systematic Name

English

BENZENEETHANOL, .ALPHA.-(4-(2-(DIETHYLAMINO)ETHOXY)PHENYL)-.BETA.-ETHYL-4-METHOXY-.ALPHA.-PHENYL-, 2-HYDROXY-1,2,3-PROPANETRICARBOXYLATE (1:1) (SALT)

Systematic Name

English

Code System Code Type Description

PUBCHEM

215230

Created by admin on Sat Dec 16 09:51:33 GMT 2023 , Edited by admin on Sat Dec 16 09:51:33 GMT 2023

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EPA CompTox

DTXSID50956705

Created by admin on Sat Dec 16 09:51:33 GMT 2023 , Edited by admin on Sat Dec 16 09:51:33 GMT 2023

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CAS

35263-93-5

Created by admin on Sat Dec 16 09:51:33 GMT 2023 , Edited by admin on Sat Dec 16 09:51:33 GMT 2023

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FDA UNII

N6220RDT93

Created by admin on Sat Dec 16 09:51:33 GMT 2023 , Edited by admin on Sat Dec 16 09:51:33 GMT 2023

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