4-[(2-cyano-3-naphthalen-1-yl-prop-2-enoyl)amino]benzoic acid

Systemtic Name: 4-[(2-cyano-3-naphthalen-1-yl-prop-2-enoyl)amino]benzoic acid Openeye Name: 4-[[2-cyano-3-(1-naphthyl)prop-2-enoyl]amino]benzoic acid CAS Name: 4-[[2-cyano-3-(1-naphthalenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 4-[(2-cyano-3-naphthalen-1-ylprop-2-enoyl)amino]benzoic acid Traditional Name: 4-[[2-cyano-3-(1-naphthyl)acryloyl]amino]benzoic acid Formula: C21H14N2O3 MolecularWeight: 342.34746

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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=C2C=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)