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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14O4
Molecular Weight 270.28
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(4-METHOXYBENZOYLMETHYL)BENZOIC ACID

SMILES

COC1=CC=C(C=C1)C(=O)CC2=CC=CC=C2C(O)=O

InChI

InChIKey=DPXWHZUTDZONDB-UHFFFAOYSA-N
InChI=1S/C16H14O4/c1-20-13-8-6-11(7-9-13)15(17)10-12-4-2-3-5-14(12)16(18)19/h2-9H,10H2,1H3,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C16H14O4
Molecular Weight 270.28
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:55:46 GMT 2023
Edited
by admin
on Sat Dec 16 12:55:46 GMT 2023
Record UNII
XBW8WR21TV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(4-METHOXYBENZOYLMETHYL)BENZOIC ACID
Systematic Name English
NSC-123016
Code English
2-(2-(4-METHOXYPHENYL)-2-OXOETHYL)BENZOIC ACID
Systematic Name English
F-1271
Code English
O-TOLUIC ACID, .ALPHA.-P-ANISOYL-
Systematic Name English
BENZOIC ACID, 2-(2-(4-METHOXYPHENYL)-2-OXOETHYL)-
Systematic Name English
O-TOLUIC ACID, ALPHA-(P-METHOXYBENZOYL)-
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID40187187
Created by admin on Sat Dec 16 12:55:46 GMT 2023 , Edited by admin on Sat Dec 16 12:55:46 GMT 2023
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NSC
123016
Created by admin on Sat Dec 16 12:55:46 GMT 2023 , Edited by admin on Sat Dec 16 12:55:46 GMT 2023
PRIMARY
PUBCHEM
97435
Created by admin on Sat Dec 16 12:55:46 GMT 2023 , Edited by admin on Sat Dec 16 12:55:46 GMT 2023
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CAS
33533-90-3
Created by admin on Sat Dec 16 12:55:46 GMT 2023 , Edited by admin on Sat Dec 16 12:55:46 GMT 2023
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FDA UNII
XBW8WR21TV
Created by admin on Sat Dec 16 12:55:46 GMT 2023 , Edited by admin on Sat Dec 16 12:55:46 GMT 2023
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