3-[(E)-3-(3-carboxyphenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid

Systemtic Name: 3-[(E)-3-(3-carboxyphenyl)-3-oxidanylidene-prop-1-enyl]benzoic acid Openeye Name: 3-[(E)-3-(3-carboxyphenyl)-3-oxo-prop-1-enyl]benzoic acid CAS Name: 3-[(E)-3-(3-carboxyphenyl)-3-oxoprop-1-enyl]benzoic acid IUPAC Name: 3-[(E)-3-(3-carboxyphenyl)-3-oxoprop-1-enyl]benzoic acid Traditional Name: 3-[(E)-3-(3-carboxyphenyl)-3-keto-prop-1-enyl]benzoic acid Formula: C17H12O5 MolecularWeight: 296.27418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)O)C=CC(=O)C2=CC(=CC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)O)/C=C/C(=O)C2=CC(=CC=C2)C(=O)O

InChI

InChI=1S/C17H12O5/c18-15(12-4-2-6-14(10-12)17(21)22)8-7-11-3-1-5-13(9-11)16(19)20/h1-10H,(H,19,20)(H,21,22)/b8-7+