methyl (4S)-4-(6-methyl-4-oxidanylidene-heptan-2-yl)cyclohexene-1-carboxylate

Systemtic Name: methyl (4S)-4-(6-methyl-4-oxidanylidene-heptan-2-yl)cyclohexene-1-carboxylate Openeye Name: methyl (4S)-4-(1,5-dimethyl-3-oxo-hexyl)cyclohexene-1-carboxylate CAS Name: (4S)-4-(6-methyl-4-oxoheptan-2-yl)-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (4S)-4-(6-methyl-4-oxoheptan-2-yl)cyclohexene-1-carboxylate Traditional Name: (4S)-4-(3-keto-1,5-dimethyl-hexyl)cyclohexene-1-carboxylic acid methyl ester Formula: C16H26O3 MolecularWeight: 266.37584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)CC(C)C1CCC(=CC1)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)CC(C)[C@H]1CCC(=CC1)C(=O)OC

InChI

InChI=1S/C16H26O3/c1-11(2)9-15(17)10-12(3)13-5-7-14(8-6-13)16(18)19-4/h7,11-13H,5-6,8-10H2,1-4H3/t12?,13-/m1/s1