dimethyl 2-[(S)-(4-methoxyphenyl)-[(1S)-2-oxidanylidenecyclohexyl]methyl]propanedioate

Systemtic Name: dimethyl 2-[(S)-(4-methoxyphenyl)-[(1S)-2-oxidanylidenecyclohexyl]methyl]propanedioate Openeye Name: dimethyl 2-[(S)-(4-methoxyphenyl)-[(1S)-2-oxocyclohexyl]methyl]propanedioate CAS Name: 2-[(S)-(4-methoxyphenyl)-[(1S)-2-oxocyclohexyl]methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(S)-(4-methoxyphenyl)-[(1S)-2-oxocyclohexyl]methyl]propanedioate Traditional Name: 2-[(S)-[(1S)-2-ketocyclohexyl]-(4-methoxyphenyl)methyl]malonic acid dimethyl ester Formula: C19H24O6 MolecularWeight: 348.39026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2CCCCC2=O)C(C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]([C@@H]2CCCCC2=O)C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C19H24O6/c1-23-13-10-8-12(9-11-13)16(14-6-4-5-7-15(14)20)17(18(21)24-2)19(22)25-3/h8-11,14,16-17H,4-7H2,1-3H3/t14-,16+/m1/s1