4-[[(E)-2-cyano-3-(2-methylphenyl)prop-2-enoyl]amino]benzoate

Systemtic Name: 4-[[(E)-2-cyano-3-(2-methylphenyl)prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(E)-2-cyano-3-(o-tolyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-(2-methylphenyl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-2-cyano-3-(2-methylphenyl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-(o-tolyl)acryloyl]amino]benzoate Formula: C18H13N2O3- MolecularWeight: 305.30742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C=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/c1-12-4-2-3-5-14(12)10-15(11-19)17(21)20-16-8-6-13(7-9-16)18(22)23/h2-10H,1H3,(H,20,21)(H,22,23)/p-1/b15-10+