3-[[2-cyano-3-(4-methylphenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[2-cyano-3-(4-methylphenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 3-[[2-cyano-3-(p-tolyl)prop-2-enoyl]amino]benzoic acid CAS Name: 3-[[2-cyano-3-(4-methylphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-[[2-cyano-3-(4-methylphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 3-[[2-cyano-3-(p-tolyl)acryloyl]amino]benzoic acid Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H14N2O3/c1-12-5-7-13(8-6-12)9-15(11-19)17(21)20-16-4-2-3-14(10-16)18(22)23/h2-10H,1H3,(H,20,21)(H,22,23)