2-[3-(3-methoxy-4-oxidanyl-phenyl)propanoylamino]-4-oxidanyl-benzoic acid

Systemtic Name: 2-[3-(3-methoxy-4-oxidanyl-phenyl)propanoylamino]-4-oxidanyl-benzoic acid Openeye Name: 4-hydroxy-2-[3-(4-hydroxy-3-methoxy-phenyl)propanoylamino]benzoic acid CAS Name: 4-hydroxy-2-[[3-(4-hydroxy-3-methoxyphenyl)-1-oxopropyl]amino]benzoic acid IUPAC Name: 4-hydroxy-2-[3-(4-hydroxy-3-methoxyphenyl)propanoylamino]benzoic acid Traditional Name: 4-hydroxy-2-[3-(4-hydroxy-3-methoxy-phenyl)propanoylamino]benzoic acid Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO6/c1-24-15-8-10(2-6-14(15)20)3-7-16(21)18-13-9-11(19)4-5-12(13)17(22)23/h2,4-6,8-9,19-20H,3,7H2,1H3,(H,18,21)(H,22,23)