3-[[2-cyano-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 3-[[2-cyano-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]benzoic acid Openeye Name: 3-[[2-cyano-3-(5-methyl-2-furyl)prop-2-enoyl]amino]benzoic acid CAS Name: 3-[[2-cyano-3-(5-methyl-2-furanyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 3-[[2-cyano-3-(5-methylfuran-2-yl)prop-2-enoyl]amino]benzoic acid Traditional Name: 3-[[2-cyano-3-(5-methyl-2-furyl)acryloyl]amino]benzoic acid Formula: C16H12N2O4 MolecularWeight: 296.27748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CC1=CC=C(O1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C16H12N2O4/c1-10-5-6-14(22-10)8-12(9-17)15(19)18-13-4-2-3-11(7-13)16(20)21/h2-8H,1H3,(H,18,19)(H,20,21)