5-[[3-(3,4-dimethoxyphenyl)propanoylamino]methyl]-2-methoxy-benzoic acid

Systemtic Name: 5-[[3-(3,4-dimethoxyphenyl)propanoylamino]methyl]-2-methoxy-benzoic acid Openeye Name: 5-[[3-(3,4-dimethoxyphenyl)propanoylamino]methyl]-2-methoxy-benzoic acid CAS Name: 5-[[[3-(3,4-dimethoxyphenyl)-1-oxopropyl]amino]methyl]-2-methoxybenzoic acid IUPAC Name: 5-[[3-(3,4-dimethoxyphenyl)propanoylamino]methyl]-2-methoxybenzoic acid Traditional Name: 5-[[3-(3,4-dimethoxyphenyl)propanoylamino]methyl]-2-methoxy-benzoic acid Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC(=O)CCC2=CC(=C(C=C2)OC)OC)C(=O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CNC(=O)CCC2=CC(=C(C=C2)OC)OC)C(=O)O

InChI

InChI=1S/C20H23NO6/c1-25-16-7-5-14(10-15(16)20(23)24)12-21-19(22)9-6-13-4-8-17(26-2)18(11-13)27-3/h4-5,7-8,10-11H,6,9,12H2,1-3H3,(H,21,22)(H,23,24)