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

Systemtic Name: 4-[2-[2-methoxy-4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenoxy]ethanoylamino]benzoic acid Openeye Name: 4-[[2-[4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]-2-methoxy-phenoxy]acetyl]amino]benzoic acid CAS Name: 4-[[2-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2-methoxyphenoxy]-1-oxoethyl]amino]benzoic acid IUPAC Name: 4-[[2-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]-2-methoxyphenoxy]acetyl]amino]benzoic acid Traditional Name: 4-[[2-[4-[(E)-3-hydroxy-3-keto-prop-1-enyl]-2-methoxy-phenoxy]acetyl]amino]benzoic acid Formula: C19H17NO7 MolecularWeight: 371.34078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)O)OCC(=O)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)O)OCC(=O)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C19H17NO7/c1-26-16-10-12(3-9-18(22)23)2-8-15(16)27-11-17(21)20-14-6-4-13(5-7-14)19(24)25/h2-10H,11H2,1H3,(H,20,21)(H,22,23)(H,24,25)/b9-3+