ethyl 4-[4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]piperidin-1-yl]benzoate

Systemtic Name: ethyl 4-[4-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]piperidin-1-yl]benzoate Openeye Name: ethyl 4-[4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]-1-piperidyl]benzoate CAS Name: 4-[4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]-1-piperidinyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]piperidin-1-yl]benzoate Traditional Name: 4-[4-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]piperidino]benzoic acid ethyl ester Formula: C22H27ClN2O3 MolecularWeight: 402.91438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CCC(CC2)NCC(C3=CC(=CC=C3)Cl)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CCC(CC2)NCC(C3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C22H27ClN2O3/c1-2-28-22(27)16-6-8-20(9-7-16)25-12-10-19(11-13-25)24-15-21(26)17-4-3-5-18(23)14-17/h3-9,14,19,21,24,26H,2,10-13,15H2,1H3