methyl 2-[2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-cyclohex-2-en-1-yl]ethanoate

Systemtic Name: methyl 2-[2-(1,3-benzodioxol-5-yl)-4-oxidanylidene-cyclohex-2-en-1-yl]ethanoate Openeye Name: methyl 2-[2-(1,3-benzodioxol-5-yl)-4-oxo-cyclohex-2-en-1-yl]acetate CAS Name: 2-[2-(1,3-benzodioxol-5-yl)-4-oxo-1-cyclohex-2-enyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(1,3-benzodioxol-5-yl)-4-oxocyclohex-2-en-1-yl]acetate Traditional Name: 2-[2-(1,3-benzodioxol-5-yl)-4-keto-cyclohex-2-en-1-yl]acetic acid methyl ester Formula: C16H16O5 MolecularWeight: 288.29524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CCC(=O)C=C1C2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)CC1CCC(=O)C=C1C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H16O5/c1-19-16(18)7-11-2-4-12(17)8-13(11)10-3-5-14-15(6-10)21-9-20-14/h3,5-6,8,11H,2,4,7,9H2,1H3