5-(Biphenyl-4-yl)-4-[(tert-butoxycarbonyl)amino]-2-methylpentanoic acid ethyl ester, (2R,4S)-

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C25H33NO4
Molecular Weight	411.5338
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-(Biphenyl-4-yl)-4-[(tert-butoxycarbonyl)amino]-2-methylpentanoic acid ethyl ester, (2R,4S)-

Structure Search

SMILES

CCOC(=O)[C@H](C)C[C@@H](CC1=CC=C(C=C1)C2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChIKey=LMTIKWPJTDSUPT-GCJKJVERSA-N

InChI=1S/C25H33NO4/c1-6-29-23(27)18(2)16-22(26-24(28)30-25(3,4)5)17-19-12-14-21(15-13-19)20-10-8-7-9-11-20/h7-15,18,22H,6,16-17H2,1-5H3,(H,26,28)/t18-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C25H33NO4
Molecular Weight	411.5338
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 17:31:18 GMT 2025` Edited by `admin` on `Wed Apr 02 17:31:18 GMT 2025`
Record UNII	6CV7C8ZME3
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-(Biphenyl-4-yl)-4-[(tert-butoxycarbonyl)amino]-2-methylpentanoic acid ethyl ester, (2R,4S)-

Systematic Name

English

(2R,4S)-5-(Biphenyl-4-yl)-4-[(tert-butoxycarbonyl)amino]-2-methylpentanoic acid ethyl ester

Preferred Name

English

Ethyl (?R,?S)-?-[[(1,1-dimethylethoxy)carbonyl]amino]-?-methyl[1,1?-biphenyl]-4-pentanoate

Systematic Name

English

[1,1?-Biphenyl]-4-pentanoic acid, ?-[[(1,1-dimethylethoxy)carbonyl]amino]-?-methyl-, ethyl ester, (?R,?S)-

Systematic Name

English

[1,1?-Biphenyl]-4-pentanoic acid, ?-[[(1,1-dimethylethoxy)carbonyl]amino]-?-methyl-, ethyl ester, [S-(R*,S*)]-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID901121953

Created by admin on Wed Apr 02 17:31:18 GMT 2025 , Edited by admin on Wed Apr 02 17:31:18 GMT 2025

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PUBCHEM

58027501

Created by admin on Wed Apr 02 17:31:18 GMT 2025 , Edited by admin on Wed Apr 02 17:31:18 GMT 2025

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CAS

149709-60-4

Created by admin on Wed Apr 02 17:31:18 GMT 2025 , Edited by admin on Wed Apr 02 17:31:18 GMT 2025

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FDA UNII

6CV7C8ZME3

Created by admin on Wed Apr 02 17:31:18 GMT 2025 , Edited by admin on Wed Apr 02 17:31:18 GMT 2025

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