2-[(4-cyanophenyl)carbamoylamino]-3-methyl-benzoic acid

Systemtic Name: 2-[(4-cyanophenyl)carbamoylamino]-3-methyl-benzoic acid Openeye Name: 2-[(4-cyanophenyl)carbamoylamino]-3-methyl-benzoic acid CAS Name: 2-[[(4-cyanoanilino)-oxomethyl]amino]-3-methylbenzoic acid IUPAC Name: 2-[(4-cyanophenyl)carbamoylamino]-3-methylbenzoic acid Traditional Name: 2-[(4-cyanophenyl)carbamoylamino]-3-methyl-benzoic acid Formula: C16H13N3O3 MolecularWeight: 295.29272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1NC(=O)NC2=CC=C(C=C2)C#N)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1NC(=O)NC2=CC=C(C=C2)C#N)C(=O)O

InChI

InChI=1S/C16H13N3O3/c1-10-3-2-4-13(15(20)21)14(10)19-16(22)18-12-7-5-11(9-17)6-8-12/h2-8H,1H3,(H,20,21)(H2,18,19,22)