N-(1,3-benzodioxol-4-ylmethyl)-1-(1-cyclohexylpiperidin-3-yl)-N-(pyridin-3-ylmethyl)methanamine

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-1-(1-cyclohexylpiperidin-3-yl)-N-(pyridin-3-ylmethyl)methanamine Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-1-(1-cyclohexyl-3-piperidyl)-N-(3-pyridylmethyl)methanamine CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-1-(1-cyclohexyl-3-piperidinyl)-N-(3-pyridinylmethyl)methanamine IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-1-(1-cyclohexylpiperidin-3-yl)-N-(pyridin-3-ylmethyl)methanamine Traditional Name: 1,3-benzodioxol-4-ylmethyl-[(1-cyclohexyl-3-piperidyl)methyl]-(3-pyridylmethyl)amine Formula: C26H35N3O2 MolecularWeight: 421.575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCCC(C2)CN(CC3=CN=CC=C3)CC4=C5C(=CC=C4)OCO5

Isomeric SMILES

C1CCC(CC1)N2CCCC(C2)CN(CC3=CN=CC=C3)CC4=C5C(=CC=C4)OCO5

InChI

InChI=1S/C26H35N3O2/c1-2-10-24(11-3-1)29-14-6-8-22(18-29)17-28(16-21-7-5-13-27-15-21)19-23-9-4-12-25-26(23)31-20-30-25/h4-5,7,9,12-13,15,22,24H,1-3,6,8,10-11,14,16-20H2