pentan-3-yl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium

Systemtic Name: pentan-3-yl-[1-(phenylmethyl)piperidin-1-ium-4-yl]azanium Openeye Name: (1-benzylpiperidin-1-ium-4-yl)-(1-ethylpropyl)ammonium CAS Name: pentan-3-yl-[1-(phenylmethyl)-4-piperidin-1-iumyl]ammonium IUPAC Name: (1-benzylpiperidin-1-ium-4-yl)-pentan-3-ylazanium Traditional Name: (1-benzylpiperidin-1-ium-4-yl)-(1-ethylpropyl)ammonium Formula: C17H30N2+2 MolecularWeight: 262.4335

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H28N2/c1-3-16(4-2)18-17-10-12-19(13-11-17)14-15-8-6-5-7-9-15/h5-9,16-18H,3-4,10-14H2,1-2H3/p+2