4-butyl-N-phenyl-1-(phenylmethyl)piperidin-1-ium-1-amine

Systemtic Name: 4-butyl-N-phenyl-1-(phenylmethyl)piperidin-1-ium-1-amine Openeye Name: 1-benzyl-4-butyl-N-phenyl-piperidin-1-ium-1-amine CAS Name: 4-butyl-N-phenyl-1-(phenylmethyl)-1-piperidin-1-iumamine IUPAC Name: 1-benzyl-4-butyl-N-phenylpiperidin-1-ium-1-amine Traditional Name: (1-benzyl-4-butyl-piperidin-1-ium-1-yl)-phenyl-amine Formula: C22H31N2+ MolecularWeight: 323.49494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CC[N+](CC1)(CC2=CC=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CCCCC1CC[N+](CC1)(CC2=CC=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C22H31N2/c1-2-3-10-20-15-17-24(18-16-20,19-21-11-6-4-7-12-21)23-22-13-8-5-9-14-22/h4-9,11-14,20,23H,2-3,10,15-19H2,1H3/q+1