4-(4-methoxyphenyl)butyl (2S)-1-(2-cyclohexyl-2-oxidanylidene-ethanoyl)piperidine-2-carboxylate

Systemtic Name: 4-(4-methoxyphenyl)butyl (2S)-1-(2-cyclohexyl-2-oxidanylidene-ethanoyl)piperidine-2-carboxylate Openeye Name: 4-(4-methoxyphenyl)butyl (2S)-1-(2-cyclohexyl-2-oxo-acetyl)piperidine-2-carboxylate CAS Name: (2S)-1-(2-cyclohexyl-1,2-dioxoethyl)-2-piperidinecarboxylic acid 4-(4-methoxyphenyl)butyl ester IUPAC Name: 4-(4-methoxyphenyl)butyl (2S)-1-(2-cyclohexyl-2-oxoacetyl)piperidine-2-carboxylate Traditional Name: (2S)-1-(2-cyclohexyl-2-keto-acetyl)pipecolinic acid 4-(4-methoxyphenyl)butyl ester Formula: C25H35NO5 MolecularWeight: 429.5491

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCOC(=O)C2CCCCN2C(=O)C(=O)C3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)CCCCOC(=O)[C@@H]2CCCCN2C(=O)C(=O)C3CCCCC3

InChI

InChI=1S/C25H35NO5/c1-30-21-15-13-19(14-16-21)9-6-8-18-31-25(29)22-12-5-7-17-26(22)24(28)23(27)20-10-3-2-4-11-20/h13-16,20,22H,2-12,17-18H2,1H3/t22-/m0/s1