2-methylpropyl (2Z)-2-(1,3-benzodioxol-4-ylmethylidene)-3-oxidanylidene-butanoate

Systemtic Name: 2-methylpropyl (2Z)-2-(1,3-benzodioxol-4-ylmethylidene)-3-oxidanylidene-butanoate Openeye Name: isobutyl (2Z)-2-(1,3-benzodioxol-4-ylmethylene)-3-oxo-butanoate CAS Name: (2Z)-2-(1,3-benzodioxol-4-ylmethylidene)-3-oxobutanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl (2Z)-2-(1,3-benzodioxol-4-ylmethylidene)-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-(1,3-benzodioxol-4-yl)acrylic acid isobutyl ester Formula: C16H18O5 MolecularWeight: 290.31112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C(=CC1=C2C(=CC=C1)OCO2)C(=O)C

Isomeric SMILES

CC(C)COC(=O)/C(=C\C1=C2C(=CC=C1)OCO2)/C(=O)C

InChI

InChI=1S/C16H18O5/c1-10(2)8-19-16(18)13(11(3)17)7-12-5-4-6-14-15(12)21-9-20-14/h4-7,10H,8-9H2,1-3H3/b13-7-