methyl 8-[4-[(4-chlorophenyl)-phenyl-methoxy]piperidin-1-yl]octanoate

Systemtic Name: methyl 8-[4-[(4-chlorophenyl)-phenyl-methoxy]piperidin-1-yl]octanoate Openeye Name: methyl 8-[4-[(4-chlorophenyl)-phenyl-methoxy]-1-piperidyl]octanoate CAS Name: 8-[4-[(4-chlorophenyl)-phenylmethoxy]-1-piperidinyl]octanoic acid methyl ester IUPAC Name: methyl 8-[4-[(4-chlorophenyl)-phenylmethoxy]piperidin-1-yl]octanoate Traditional Name: 8-[4-[(4-chlorophenyl)-phenyl-methoxy]piperidino]caprylic acid methyl ester Formula: C27H36ClNO3 MolecularWeight: 458.03264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCCCN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

COC(=O)CCCCCCCN1CCC(CC1)OC(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C27H36ClNO3/c1-31-26(30)12-8-3-2-4-9-19-29-20-17-25(18-21-29)32-27(22-10-6-5-7-11-22)23-13-15-24(28)16-14-23/h5-7,10-11,13-16,25,27H,2-4,8-9,12,17-21H2,1H3