2-Benzamidobenzoic acid; 4-Methoxy

AlkaPlorer ID: AK179969

Synonym: 2-Benzamido-4-methoxybenzoic acid, N-Benzoyl-4-methoxyanthranilic acid, 4-Methoxydianthramide B 

IUPAC Name: 2-benzamido-4-methoxybenzoic acid

Structure

SMILES: COC1=CC=C(C(=O)O)C(N=C(O)C2=CC=CC=C2)=C1

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InChI: InChI=1S/C15H13NO4/c1-20-11-7-8-12(15(18)19)13(9-11)16-14(17)10-5-3-2-4-6-10/h2-9H,1H3,(H,16,17)(H,18,19)

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InChIKey: NZSBJWOTLHVBNU-UHFFFAOYSA-N

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Source

Properties Information

Molecule Weight: 271.272

TPSA: 79.12

MolLogP: 3.029700000000001

Number of H-Donors: 2

Number of H-Acceptors: 3

RingCount: 2

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT014716 C[SAH].O=C(Nc1cc(O)ccc1C(=O)O)c1ccccc1>>COc1ccc(C(=O)O)c(NC(=O)c2ccccc2)c1 2.1.1.105-RXN