2-methylpropyl 1-(3-chloranylpropyl)-3-(2-methylpropoxy)-5-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: 2-methylpropyl 1-(3-chloranylpropyl)-3-(2-methylpropoxy)-5-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: isobutyl 1-(3-chloropropyl)-3-isobutoxy-5-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 1-(3-chloropropyl)-3-(2-methylpropoxy)-5-oxo-1-cyclohex-3-enecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 1-(3-chloropropyl)-3-(2-methylpropoxy)-5-oxocyclohex-3-ene-1-carboxylate Traditional Name: 1-(3-chloropropyl)-3-isobutoxy-5-keto-cyclohex-3-ene-1-carboxylic acid isobutyl ester Formula: C18H29ClO4 MolecularWeight: 344.87346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC(=O)CC(C1)(CCCCl)C(=O)OCC(C)C

Isomeric SMILES

CC(C)COC1=CC(=O)CC(C1)(CCCCl)C(=O)OCC(C)C

InChI

InChI=1S/C18H29ClO4/c1-13(2)11-22-16-8-15(20)9-18(10-16,6-5-7-19)17(21)23-12-14(3)4/h8,13-14H,5-7,9-12H2,1-4H3