3-[[4-[(E)-2-benzamido-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[(E)-2-benzamido-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[(E)-2-benzamido-3-hydroxy-3-oxo-prop-1-enyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[(E)-2-benzamido-3-hydroxy-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[(E)-2-benzamido-3-hydroxy-3-oxoprop-1-enyl]phenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[(E)-2-benzamido-3-hydroxy-3-keto-prop-1-enyl]phenoxy]methyl]benzoic acid Formula: C24H19NO6 MolecularWeight: 417.41076

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CC=C(C=C2)OCC3=CC=CC(=C3)C(=O)O)/C(=O)O

InChI

InChI=1S/C24H19NO6/c26-22(18-6-2-1-3-7-18)25-21(24(29)30)14-16-9-11-20(12-10-16)31-15-17-5-4-8-19(13-17)23(27)28/h1-14H,15H2,(H,25,26)(H,27,28)(H,29,30)/b21-14+