2-[5-[(E)-3-(4-carboxyphenyl)-3-oxidanylidene-prop-1-enyl]-2,4-dimethoxy-phenyl]indole-1-carboxylic acid

Systemtic Name: 2-[5-[(E)-3-(4-carboxyphenyl)-3-oxidanylidene-prop-1-enyl]-2,4-dimethoxy-phenyl]indole-1-carboxylic acid Openeye Name: 2-[5-[(E)-3-(4-carboxyphenyl)-3-oxo-prop-1-enyl]-2,4-dimethoxy-phenyl]indole-1-carboxylic acid CAS Name: 2-[5-[(E)-3-(4-carboxyphenyl)-3-oxoprop-1-enyl]-2,4-dimethoxyphenyl]-1-indolecarboxylic acid IUPAC Name: 2-[5-[(E)-3-(4-carboxyphenyl)-3-oxoprop-1-enyl]-2,4-dimethoxyphenyl]indole-1-carboxylic acid Traditional Name: 2-[5-[(E)-3-(4-carboxyphenyl)-3-keto-prop-1-enyl]-2,4-dimethoxy-phenyl]indole-1-carboxylic acid Formula: C27H21NO7 MolecularWeight: 471.45814

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC3=CC=CC=C3N2C(=O)O)C=CC(=O)C4=CC=C(C=C4)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC3=CC=CC=C3N2C(=O)O)/C=C/C(=O)C4=CC=C(C=C4)C(=O)O)OC

InChI

InChI=1S/C27H21NO7/c1-34-24-15-25(35-2)20(22-14-18-5-3-4-6-21(18)28(22)27(32)33)13-19(24)11-12-23(29)16-7-9-17(10-8-16)26(30)31/h3-15H,1-2H3,(H,30,31)(H,32,33)/b12-11+