butyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: butyl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-butyl-ammonium CAS Name: butyl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-butylazanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-butyl-ammonium Formula: C16H28N2+2 MolecularWeight: 248.40692

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH2+]C1CC[NH+](CC1)CC2=CC=CC=C2

Isomeric SMILES

CCCC[NH2+]C1CC[NH+](CC1)CC2=CC=CC=C2

InChI

InChI=1S/C16H26N2/c1-2-3-11-17-16-9-12-18(13-10-16)14-15-7-5-4-6-8-15/h4-8,16-17H,2-3,9-14H2,1H3/p+2