6-[2-phenyl-3-[(2-propan-2-yloxyphenyl)methylamino]piperidin-1-yl]hexane-1,2-diol

Systemtic Name: 6-[2-phenyl-3-[(2-propan-2-yloxyphenyl)methylamino]piperidin-1-yl]hexane-1,2-diol Openeye Name: 6-[3-[(2-isopropoxyphenyl)methylamino]-2-phenyl-1-piperidyl]hexane-1,2-diol CAS Name: 6-[2-phenyl-3-[(2-propan-2-yloxyphenyl)methylamino]-1-piperidinyl]hexane-1,2-diol IUPAC Name: 6-[2-phenyl-3-[(2-propan-2-yloxyphenyl)methylamino]piperidin-1-yl]hexane-1,2-diol Traditional Name: 6-[3-[(2-isopropoxybenzyl)amino]-2-phenyl-piperidino]hexane-1,2-diol Formula: C27H40N2O3 MolecularWeight: 440.6181

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC=C1CNC2CCCN(C2C3=CC=CC=C3)CCCCC(CO)O

Isomeric SMILES

CC(C)OC1=CC=CC=C1CNC2CCCN(C2C3=CC=CC=C3)CCCCC(CO)O

InChI

InChI=1S/C27H40N2O3/c1-21(2)32-26-16-7-6-13-23(26)19-28-25-15-10-18-29(17-9-8-14-24(31)20-30)27(25)22-11-4-3-5-12-22/h3-7,11-13,16,21,24-25,27-28,30-31H,8-10,14-15,17-20H2,1-2H3