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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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