3-[[3,3-bis(4-methoxyphenyl)piperidin-1-yl]methyl]-N-(cyanomethyl)-N-methyl-benzamide

Systemtic Name: 3-[[3,3-bis(4-methoxyphenyl)piperidin-1-yl]methyl]-N-(cyanomethyl)-N-methyl-benzamide Openeye Name: 3-[[3,3-bis(4-methoxyphenyl)-1-piperidyl]methyl]-N-(cyanomethyl)-N-methyl-benzamide CAS Name: 3-[[3,3-bis(4-methoxyphenyl)-1-piperidinyl]methyl]-N-(cyanomethyl)-N-methylbenzamide IUPAC Name: 3-[[3,3-bis(4-methoxyphenyl)piperidin-1-yl]methyl]-N-(cyanomethyl)-N-methylbenzamide Traditional Name: 3-[[3,3-bis(4-methoxyphenyl)piperidino]methyl]-N-(cyanomethyl)-N-methyl-benzamide Formula: C30H33N3O3 MolecularWeight: 483.60132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC#N)C(=O)C1=CC(=CC=C1)CN2CCCC(C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(CC#N)C(=O)C1=CC(=CC=C1)CN2CCCC(C2)(C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC

InChI

InChI=1S/C30H33N3O3/c1-32(19-17-31)29(34)24-7-4-6-23(20-24)21-33-18-5-16-30(22-33,25-8-12-27(35-2)13-9-25)26-10-14-28(36-3)15-11-26/h4,6-15,20H,5,16,18-19,21-22H2,1-3H3