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

Systemtic Name: 5-[5-[(E)-3-(4-carboxyphenyl)-3-oxidanylidene-prop-1-enyl]-2,4-dimethoxy-phenyl]thiophene-2-carboxylic acid Openeye Name: 5-[5-[(E)-3-(4-carboxyphenyl)-3-oxo-prop-1-enyl]-2,4-dimethoxy-phenyl]thiophene-2-carboxylic acid CAS Name: 5-[5-[(E)-3-(4-carboxyphenyl)-3-oxoprop-1-enyl]-2,4-dimethoxyphenyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[5-[(E)-3-(4-carboxyphenyl)-3-oxoprop-1-enyl]-2,4-dimethoxyphenyl]thiophene-2-carboxylic acid Traditional Name: 5-[5-[(E)-3-(4-carboxyphenyl)-3-keto-prop-1-enyl]-2,4-dimethoxy-phenyl]-2-thenoic acid Formula: C23H18O7S MolecularWeight: 438.44982

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=C(S2)C(=O)O)C=CC(=O)C3=CC=C(C=C3)C(=O)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=C(S2)C(=O)O)/C=C/C(=O)C3=CC=C(C=C3)C(=O)O)OC

InChI

InChI=1S/C23H18O7S/c1-29-18-12-19(30-2)16(20-9-10-21(31-20)23(27)28)11-15(18)7-8-17(24)13-3-5-14(6-4-13)22(25)26/h3-12H,1-2H3,(H,25,26)(H,27,28)/b8-7+