1-methyl-4-[4-(phenylmethyl)piperidin-1-ium-1-yl]piperidin-1-ium

Systemtic Name: 1-methyl-4-[4-(phenylmethyl)piperidin-1-ium-1-yl]piperidin-1-ium Openeye Name: 4-benzyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium CAS Name: 1-methyl-4-[4-(phenylmethyl)-1-piperidin-1-iumyl]piperidin-1-ium IUPAC Name: 4-benzyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium Traditional Name: 4-benzyl-1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium Formula: C18H30N2+2 MolecularWeight: 274.4442

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH+]2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)[NH+]2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C18H28N2/c1-19-11-9-18(10-12-19)20-13-7-17(8-14-20)15-16-5-3-2-4-6-16/h2-6,17-18H,7-15H2,1H3/p+2