MCN-5691

Details

Stereochemistry	RACEMIC
Molecular Formula	C30H35NO3
Molecular Weight	457.6038
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0
Stereo Comments	Assumed racemic

SHOW SMILES / InChI

Structure Search

SMILES

COC1=CC=C(C#CC2=CC=CC=C2)C(CCC(C)N(C)CCC3=CC(OC)=C(OC)C=C3)=C1

InChI

InChIKey=HQDXNTRZJRNPLD-UHFFFAOYSA-N

InChI=1S/C30H35NO3/c1-23(31(2)20-19-25-13-18-29(33-4)30(21-25)34-5)11-14-27-22-28(32-3)17-16-26(27)15-12-24-9-7-6-8-10-24/h6-10,13,16-18,21-23H,11,14,19-20H2,1-5H3

HIDE SMILES / InChI

Molecular Formula	C30H35NO3
Molecular Weight	457.6038
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 `Mon Mar 31 18:04:35 GMT 2025` Edited by `admin` on `Mon Mar 31 18:04:35 GMT 2025`
Record UNII	6NZ1CHR0U7
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

MCN-5691

Code

English

BENZENEPROPANAMINE, N-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-5-METHOXY-N,.ALPHA.-DIMETHYL-2-(2-PHENYLETHYNYL)-

Preferred Name

English

RWJ-26240

Common Name

English

N-(2-(3,4-DIMETHOXYPHENYL)ETHYL)-5-METHOXY-N,.ALPHA.-DIMETHYL-2-(2-PHENYLETHYNYL)BENZENEPROPANAMINE

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID40912815

Created by admin on Mon Mar 31 18:04:35 GMT 2025 , Edited by admin on Mon Mar 31 18:04:35 GMT 2025

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PUBCHEM

127269

Created by admin on Mon Mar 31 18:04:35 GMT 2025 , Edited by admin on Mon Mar 31 18:04:35 GMT 2025

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CAS

99254-95-2

Created by admin on Mon Mar 31 18:04:35 GMT 2025 , Edited by admin on Mon Mar 31 18:04:35 GMT 2025

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FDA UNII

6NZ1CHR0U7

Created by admin on Mon Mar 31 18:04:35 GMT 2025 , Edited by admin on Mon Mar 31 18:04:35 GMT 2025

PRIMARY