[2-methoxy-4-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 1,3-benzodioxole-5-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-3-oxidanylidene-3-phenyl-prop-1-enyl]phenyl] 1,3-benzodioxole-5-carboxylate Openeye Name: [2-methoxy-4-[(E)-3-oxo-3-phenyl-prop-1-enyl]phenyl] 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-methoxy-4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl] 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid [4-[(E)-3-keto-3-phenyl-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C24H18O6 MolecularWeight: 402.39612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)C2=CC=CC=C2)OC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C24H18O6/c1-27-22-13-16(7-10-19(25)17-5-3-2-4-6-17)8-11-21(22)30-24(26)18-9-12-20-23(14-18)29-15-28-20/h2-14H,15H2,1H3/b10-7+