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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H16O3
Molecular Weight 268.3078
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL-2-(3-BENZOYLPHENYL)PROPANOATE, (S)-

SMILES

C[C@@]([H])(c1cccc(c1)C(=O)c2ccccc2)C(=O)OC

InChI

InChIKey=BIOCOYIPJQMGTN-LBPRGKRZSA-N
InChI=1S/C17H16O3/c1-12(17(19)20-2)14-9-6-10-15(11-14)16(18)13-7-4-3-5-8-13/h3-12H,1-2H3/t12-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H16O3
Molecular Weight 268.3078
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 Jun 26 15:41:27 UTC 2021
Edited
by admin
on Sat Jun 26 15:41:27 UTC 2021
Record UNII
S65R4656M1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL-2-(3-BENZOYLPHENYL)PROPANOATE, (S)-
Systematic Name English
(S)-METHYL-2-(3-BENZOYLPHENYL)PROPANOATE
Systematic Name English
BENZENEACETIC ACID, 3-BENZOYL-.ALPHA.-METHYL-, METHYL ESTER, (S)-
Systematic Name English
KETOPROFEN RELATED COMPOUND E
USP-RS  
Common Name English
Code System Code Type Description
PUBCHEM
838943
Created by admin on Sat Jun 26 15:41:27 UTC 2021 , Edited by admin on Sat Jun 26 15:41:27 UTC 2021
PRIMARY
FDA UNII
S65R4656M1
Created by admin on Sat Jun 26 15:41:27 UTC 2021 , Edited by admin on Sat Jun 26 15:41:27 UTC 2021
PRIMARY
CAS
81601-91-4
Created by admin on Sat Jun 26 15:41:27 UTC 2021 , Edited by admin on Sat Jun 26 15:41:27 UTC 2021
PRIMARY
Related Record Type Details
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