1-[(2-methylphenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium

Systemtic Name: 1-[(2-methylphenyl)methyl]-4-piperidin-1-ium-1-yl-piperidin-1-ium Openeye Name: 1-(o-tolylmethyl)-4-piperidin-1-ium-1-yl-piperidin-1-ium CAS Name: 1-[(2-methylphenyl)methyl]-4-(1-piperidin-1-iumyl)piperidin-1-ium IUPAC Name: 1-[(2-methylphenyl)methyl]-4-piperidin-1-ium-1-ylpiperidin-1-ium Traditional Name: 1-(2-methylbenzyl)-4-piperidin-1-ium-1-yl-piperidin-1-ium Formula: C18H30N2+2 MolecularWeight: 274.4442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCCCC3

InChI

InChI=1S/C18H28N2/c1-16-7-3-4-8-17(16)15-19-13-9-18(10-14-19)20-11-5-2-6-12-20/h3-4,7-8,18H,2,5-6,9-15H2,1H3/p+2