(1S,5R)-3-[(3-phenoxyphenyl)methyl]-6-(3-piperidin-1-ylpropoxymethyl)-3-azabicyclo[3.1.0]hexane

Systemtic Name: (1S,5R)-3-[(3-phenoxyphenyl)methyl]-6-(3-piperidin-1-ylpropoxymethyl)-3-azabicyclo[3.1.0]hexane Openeye Name: (1S,5R)-3-[(3-phenoxyphenyl)methyl]-6-[3-(1-piperidyl)propoxymethyl]-3-azabicyclo[3.1.0]hexane CAS Name: (1S,5R)-3-[(3-phenoxyphenyl)methyl]-6-[3-(1-piperidinyl)propoxymethyl]-3-azabicyclo[3.1.0]hexane IUPAC Name: (1S,5R)-3-[(3-phenoxyphenyl)methyl]-6-(3-piperidin-1-ylpropoxymethyl)-3-azabicyclo[3.1.0]hexane Traditional Name: (1S,5R)-3-(3-phenoxybenzyl)-6-(3-piperidinopropoxymethyl)-3-azabicyclo[3.1.0]hexane Formula: C27H36N2O2 MolecularWeight: 420.58694

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOCC2C3C2CN(C3)CC4=CC(=CC=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)CCCOCC2[C@H]3[C@@H]2CN(C3)CC4=CC(=CC=C4)OC5=CC=CC=C5

InChI

InChI=1S/C27H36N2O2/c1-3-10-23(11-4-1)31-24-12-7-9-22(17-24)18-29-19-25-26(20-29)27(25)21-30-16-8-15-28-13-5-2-6-14-28/h1,3-4,7,9-12,17,25-27H,2,5-6,8,13-16,18-21H2/t25-,26+,27?