2-[[(E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]-5-oxidanyl-benzoic acid

Systemtic Name: 2-[[(E)-3-(3,5-dimethoxy-4-oxidanyl-phenyl)prop-2-enoyl]amino]-5-oxidanyl-benzoic acid Openeye Name: 5-hydroxy-2-[[(E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 5-hydroxy-2-[[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 5-hydroxy-2-[[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 5-hydroxy-2-[[(E)-3-(4-hydroxy-3,5-dimethoxy-phenyl)acryloyl]amino]benzoic acid Formula: C18H17NO7 MolecularWeight: 359.33008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1O)OC)C=CC(=O)NC2=C(C=C(C=C2)O)C(=O)O

Isomeric SMILES

COC1=CC(=CC(=C1O)OC)/C=C/C(=O)NC2=C(C=C(C=C2)O)C(=O)O

InChI

InChI=1S/C18H17NO7/c1-25-14-7-10(8-15(26-2)17(14)22)3-6-16(21)19-13-5-4-11(20)9-12(13)18(23)24/h3-9,20,22H,1-2H3,(H,19,21)(H,23,24)/b6-3+