2-[[(E)-3-[3-(hydroxymethyl)-4-oxidanyl-phenyl]prop-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[(E)-3-[3-(hydroxymethyl)-4-oxidanyl-phenyl]prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[(E)-3-[4-hydroxy-3-(hydroxymethyl)phenyl]prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-3-[4-hydroxy-3-(hydroxymethyl)phenyl]-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[(E)-3-[4-hydroxy-3-(hydroxymethyl)phenyl]prop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[(E)-3-(4-hydroxy-3-methylol-phenyl)acryloyl]amino]benzoic acid Formula: C17H15NO5 MolecularWeight: 313.3047

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)C=CC2=CC(=C(C=C2)O)CO

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)/C=C/C2=CC(=C(C=C2)O)CO

InChI

InChI=1S/C17H15NO5/c19-10-12-9-11(5-7-15(12)20)6-8-16(21)18-14-4-2-1-3-13(14)17(22)23/h1-9,19-20H,10H2,(H,18,21)(H,22,23)/b8-6+