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

Systemtic Name: [(2S)-4-methylpentan-2-yl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-[(1S)-1,3-dimethylbutyl]ammonium CAS Name: [(2S)-4-methylpentan-2-yl]-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-[(2S)-4-methylpentan-2-yl]azanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-[(1S)-1,3-dimethylbutyl]ammonium Formula: C18H32N2+2 MolecularWeight: 276.46008

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2/c1-15(2)13-16(3)19-18-9-11-20(12-10-18)14-17-7-5-4-6-8-17/h4-8,15-16,18-19H,9-14H2,1-3H3/p+2/t16-/m0/s1