ETHYL (2S)-(4-(((3S)-1-(TERT-BUTOXYCARBONYL)-3-PYRROLIDINYL)OXY)PHENYL)-3-(7-CYANO-2-NAPHTHYL)PROPANOATE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C31H34N2O5
Molecular Weight	514.6121
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of ETHYL (2S)-(4-(((3S)-1-(TERT-BUTOXYCARBONYL)-3-PYRROLIDINYL)OXY)PHENYL)-3-(7-CYANO-2-NAPHTHYL)PROPANOATE

Structure Search

SMILES

CCOC(=O)[C@@H](CC1=CC2=CC(=CC=C2C=C1)C#N)C3=CC=C(O[C@H]4CCN(C4)C(=O)OC(C)(C)C)C=C3

InChI

InChIKey=NMJRXFTUIGIPII-NSOVKSMOSA-N

InChI=1S/C31H34N2O5/c1-5-36-29(34)28(18-21-6-8-23-9-7-22(19-32)17-25(23)16-21)24-10-12-26(13-11-24)37-27-14-15-33(20-27)30(35)38-31(2,3)4/h6-13,16-17,27-28H,5,14-15,18,20H2,1-4H3/t27-,28-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C31H34N2O5
Molecular Weight	514.6121
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 `Fri Dec 15 15:30:52 GMT 2023` Edited by `admin` on `Fri Dec 15 15:30:52 GMT 2023`
Record UNII	HFZ1LG658G
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

ETHYL (2S)-(4-(((3S)-1-(TERT-BUTOXYCARBONYL)-3-PYRROLIDINYL)OXY)PHENYL)-3-(7-CYANO-2-NAPHTHYL)PROPANOATE

Systematic Name

English

1-PYRROLIDINECARBOXYLIC ACID, 3-(4-((1S)-1-((7-CYANO-2-NAPHTHALENYL)METHYL)-2-ETHOXY-2-OXOETHYL)PHENOXY)-, 1,1-DIMETHYLETHYL ESTER, (3S)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9983982

Created by admin on Fri Dec 15 15:30:52 GMT 2023 , Edited by admin on Fri Dec 15 15:30:52 GMT 2023

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FDA UNII

HFZ1LG658G

Created by admin on Fri Dec 15 15:30:52 GMT 2023 , Edited by admin on Fri Dec 15 15:30:52 GMT 2023

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CAS

150610-65-4

Created by admin on Fri Dec 15 15:30:52 GMT 2023 , Edited by admin on Fri Dec 15 15:30:52 GMT 2023

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