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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)NC2=CC=C(C=C2)C#N

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)NC2=CC=C(C=C2)C#N

InChI

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