4-[[(E)-2-cyano-3-naphthalen-1-yl-prop-2-enoyl]amino]benzoate

Systemtic Name: 4-[[(E)-2-cyano-3-naphthalen-1-yl-prop-2-enoyl]amino]benzoate Openeye Name: 4-[[(E)-2-cyano-3-(1-naphthyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]benzoate IUPAC Name: 4-[[(E)-2-cyano-3-naphthalen-1-ylprop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-(1-naphthyl)acryloyl]amino]benzoate Formula: C21H13N2O3- MolecularWeight: 341.33952

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2C=C(C#N)C(=O)NC3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2/C=C(\C#N)/C(=O)NC3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C21H14N2O3/c22-13-17(12-16-6-3-5-14-4-1-2-7-19(14)16)20(24)23-18-10-8-15(9-11-18)21(25)26/h1-12H,(H,23,24)(H,25,26)/p-1/b17-12+