1-(BUTYLAMINO)-3-(4-(2,2-DIMETHYL-7-METHOXY-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)-2-PROPANOL

Details

Stereochemistry	RACEMIC
Molecular Formula	C31H37NO4
Molecular Weight	487.6298
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 1-(BUTYLAMINO)-3-(4-(2,2-DIMETHYL-7-METHOXY-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)-2-PROPANOL

Structure Search

SMILES

CCCCNCC(O)COC1=CC=C(C=C1)C2=C(C3=CC=CC=C3)C(C)(C)OC4=CC(OC)=CC=C24

InChI

InChIKey=CBOYOWVNIHUFCM-UHFFFAOYSA-N

InChI=1S/C31H37NO4/c1-5-6-18-32-20-24(33)21-35-25-14-12-22(13-15-25)29-27-17-16-26(34-4)19-28(27)36-31(2,3)30(29)23-10-8-7-9-11-23/h7-17,19,24,32-33H,5-6,18,20-21H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C31H37NO4
Molecular Weight	487.6298
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:21:28 GMT 2023` Edited by `admin` on `Sat Dec 16 08:21:28 GMT 2023`
Record UNII	C80QP2GMRU
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

1-(BUTYLAMINO)-3-(4-(2,2-DIMETHYL-7-METHOXY-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)-2-PROPANOL

Systematic Name

English

2-PROPANOL, 1-(BUTYLAMINO)-3-(4-(2,2-DIMETHYL-7-METHOXY-3-PHENYL-2H-1-BENZOPYRAN-4-YL)PHENOXY)-

Systematic Name

English

Code System Code Type Description

CAS

109736-11-0

Created by admin on Sat Dec 16 08:21:28 GMT 2023 , Edited by admin on Sat Dec 16 08:21:28 GMT 2023

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PUBCHEM

3066199

Created by admin on Sat Dec 16 08:21:28 GMT 2023 , Edited by admin on Sat Dec 16 08:21:28 GMT 2023

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FDA UNII

C80QP2GMRU

Created by admin on Sat Dec 16 08:21:28 GMT 2023 , Edited by admin on Sat Dec 16 08:21:28 GMT 2023

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EPA CompTox

DTXSID70911316

Created by admin on Sat Dec 16 08:21:28 GMT 2023 , Edited by admin on Sat Dec 16 08:21:28 GMT 2023

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