[(2S,3S)-3-methylpentan-2-yl]-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30N2/c1-4-15(2)16(3)19-18-10-12-20(13-11-18)14-17-8-6-5-7-9-17/h5-9,15-16,18-19H,4,10-14H2,1-3H3/p+2/t15-,16-/m0/s1