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Details

Stereochemistry ABSOLUTE
Molecular Formula C20H23NO3
Molecular Weight 325.4015
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of BENALAXYL, (+)-

SMILES

COC(=O)[C@H](C)N(C(=O)CC1=CC=CC=C1)C2=C(C)C=CC=C2C

InChI

InChIKey=CJPQIRJHIZUAQP-INIZCTEOSA-N
InChI=1S/C20H23NO3/c1-14-9-8-10-15(2)19(14)21(16(3)20(23)24-4)18(22)13-17-11-6-5-7-12-17/h5-12,16H,13H2,1-4H3/t16-/m0/s1

HIDE SMILES / InChI

Molecular Formula C20H23NO3
Molecular Weight 325.4015
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:57:23 GMT 2023
Edited
by admin
on Sat Dec 16 08:57:23 GMT 2023
Record UNII
06UBT0512C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
BENALAXYL, (+)-
Common Name English
(+)-BENALAXYL
Common Name English
(S)-(+)-BENALAXYL
Common Name English
L-ALANINE, N-(2,6-DIMETHYLPHENYL)-N-(2-PHENYLACETYL)-, METHYL ESTER
Common Name English
N-(2,6-DIMETHYLPHENYL)-N-(2-PHENYLACETYL)-L-ALANINE METHYL ESTER
Systematic Name English
Code System Code Type Description
FDA UNII
06UBT0512C
Created by admin on Sat Dec 16 08:57:23 GMT 2023 , Edited by admin on Sat Dec 16 08:57:23 GMT 2023
PRIMARY
EPA CompTox
DTXSID20243159
Created by admin on Sat Dec 16 08:57:23 GMT 2023 , Edited by admin on Sat Dec 16 08:57:23 GMT 2023
PRIMARY
PUBCHEM
5491362
Created by admin on Sat Dec 16 08:57:23 GMT 2023 , Edited by admin on Sat Dec 16 08:57:23 GMT 2023
PRIMARY
CAS
97716-85-3
Created by admin on Sat Dec 16 08:57:23 GMT 2023 , Edited by admin on Sat Dec 16 08:57:23 GMT 2023
PRIMARY
CHEBI
82782
Created by admin on Sat Dec 16 08:57:23 GMT 2023 , Edited by admin on Sat Dec 16 08:57:23 GMT 2023
PRIMARY