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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H26N2/c1-14(2)12-17-16-8-10-18(11-9-16)13-15-6-4-3-5-7-15/h3-7,14,16-17H,8-13H2,1-2H3/p+2