N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-1-ium-4-yl]methyl]-4-phenyl-benzamide

Systemtic Name: N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-1-ium-4-yl]methyl]-4-phenyl-benzamide Openeye Name: N-ethyl-N-[[1-(1-methyl-4-piperidyl)piperidin-1-ium-4-yl]methyl]-4-phenyl-benzamide CAS Name: N-ethyl-N-[[1-(1-methyl-4-piperidinyl)-4-piperidin-1-iumyl]methyl]-4-phenylbenzamide IUPAC Name: N-ethyl-N-[[1-(1-methylpiperidin-4-yl)piperidin-1-ium-4-yl]methyl]-4-phenylbenzamide Traditional Name: N-ethyl-N-[[1-(1-methyl-4-piperidyl)piperidin-1-ium-4-yl]methyl]-4-phenyl-benzamide Formula: C27H38N3O+ MolecularWeight: 420.61012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CC[NH+](CC1)C2CCN(CC2)C)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CCN(CC1CC[NH+](CC1)C2CCN(CC2)C)C(=O)C3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H37N3O/c1-3-29(21-22-13-19-30(20-14-22)26-15-17-28(2)18-16-26)27(31)25-11-9-24(10-12-25)23-7-5-4-6-8-23/h4-12,22,26H,3,13-21H2,1-2H3/p+1