(Z)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylphenyl)-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (Z)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylphenyl)-4-oxidanylidene-but-2-enoic acid Openeye Name: (Z)-2-(1,3-benzodioxol-5-ylmethyl)-4-oxo-4-(p-tolyl)but-2-enoic acid CAS Name: (Z)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylphenyl)-4-oxo-2-butenoic acid IUPAC Name: (Z)-2-(1,3-benzodioxol-5-ylmethyl)-4-(4-methylphenyl)-4-oxobut-2-enoic acid Traditional Name: (Z)-4-keto-2-piperonyl-4-(p-tolyl)but-2-enoic acid Formula: C19H16O5 MolecularWeight: 324.32734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(CC2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C(/CC2=CC3=C(C=C2)OCO3)\C(=O)O

InChI

InChI=1S/C19H16O5/c1-12-2-5-14(6-3-12)16(20)10-15(19(21)22)8-13-4-7-17-18(9-13)24-11-23-17/h2-7,9-10H,8,11H2,1H3,(H,21,22)/b15-10-