N-methyl-N-(2-methylpropyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide

Systemtic Name: N-methyl-N-(2-methylpropyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide Openeye Name: N-isobutyl-N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide CAS Name: N-methyl-N-(2-methylpropyl)-1-[1-(3-phenylpropyl)-4-piperidin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-N-(2-methylpropyl)-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]piperidine-4-carboxamide Traditional Name: N-isobutyl-N-methyl-1-[1-(3-phenylpropyl)piperidin-1-ium-4-yl]isonipecotamide Formula: C25H42N3O+ MolecularWeight: 400.62048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(C)C(=O)C1CCN(CC1)C2CC[NH+](CC2)CCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN(C)C(=O)C1CCN(CC1)C2CC[NH+](CC2)CCCC3=CC=CC=C3

InChI

InChI=1S/C25H41N3O/c1-21(2)20-26(3)25(29)23-11-18-28(19-12-23)24-13-16-27(17-14-24)15-7-10-22-8-5-4-6-9-22/h4-6,8-9,21,23-24H,7,10-20H2,1-3H3/p+1