6-[3-[(5-chloranyl-2-methoxy-phenyl)methylamino]-2-phenyl-piperidin-1-yl]hexane-1,2-diol

Systemtic Name: 6-[3-[(5-chloranyl-2-methoxy-phenyl)methylamino]-2-phenyl-piperidin-1-yl]hexane-1,2-diol Openeye Name: 6-[3-[(5-chloro-2-methoxy-phenyl)methylamino]-2-phenyl-1-piperidyl]hexane-1,2-diol CAS Name: 6-[3-[(5-chloro-2-methoxyphenyl)methylamino]-2-phenyl-1-piperidinyl]hexane-1,2-diol IUPAC Name: 6-[3-[(5-chloro-2-methoxyphenyl)methylamino]-2-phenylpiperidin-1-yl]hexane-1,2-diol Traditional Name: 6-[3-[(5-chloro-2-methoxy-benzyl)amino]-2-phenyl-piperidino]hexane-1,2-diol Formula: C25H35ClN2O3 MolecularWeight: 447.01

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)CNC2CCCN(C2C3=CC=CC=C3)CCCCC(CO)O

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)CNC2CCCN(C2C3=CC=CC=C3)CCCCC(CO)O

InChI

InChI=1S/C25H35ClN2O3/c1-31-24-13-12-21(26)16-20(24)17-27-23-11-7-15-28(14-6-5-10-22(30)18-29)25(23)19-8-3-2-4-9-19/h2-4,8-9,12-13,16,22-23,25,27,29-30H,5-7,10-11,14-15,17-18H2,1H3