2-[(E)-1-methoxy-1-oxidanylidene-3-phenyl-but-2-en-2-yl]benzoic acid

Systemtic Name: 2-[(E)-1-methoxy-1-oxidanylidene-3-phenyl-but-2-en-2-yl]benzoic acid Openeye Name: 2-[(E)-1-methoxycarbonyl-2-phenyl-prop-1-enyl]benzoic acid CAS Name: 2-[(E)-1-methoxy-1-oxo-3-phenylbut-2-en-2-yl]benzoic acid IUPAC Name: 2-[(E)-1-methoxy-1-oxo-3-phenylbut-2-en-2-yl]benzoic acid Traditional Name: 2-[(E)-1-carbomethoxy-2-phenyl-prop-1-enyl]benzoic acid Formula: C18H16O4 MolecularWeight: 296.31724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C1=CC=CC=C1C(=O)O)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

C/C(=C(/C1=CC=CC=C1C(=O)O)\C(=O)OC)/C2=CC=CC=C2

InChI

InChI=1S/C18H16O4/c1-12(13-8-4-3-5-9-13)16(18(21)22-2)14-10-6-7-11-15(14)17(19)20/h3-11H,1-2H3,(H,19,20)/b16-12+