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

Systemtic Name: 1-methyl-4-[1-[(2-methylphenyl)methyl]piperidin-4-yl]piperazin-1-ium Openeye Name: 1-methyl-4-[1-(o-tolylmethyl)-4-piperidyl]piperazin-1-ium CAS Name: 1-methyl-4-[1-[(2-methylphenyl)methyl]-4-piperidinyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[1-[(2-methylphenyl)methyl]piperidin-4-yl]piperazin-1-ium Traditional Name: 1-methyl-4-[1-(2-methylbenzyl)-4-piperidyl]piperazin-1-ium Formula: C18H30N3+ MolecularWeight: 288.4509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCC(CC2)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCC(CC2)N3CC[NH+](CC3)C

InChI

InChI=1S/C18H29N3/c1-16-5-3-4-6-17(16)15-20-9-7-18(8-10-20)21-13-11-19(2)12-14-21/h3-6,18H,7-15H2,1-2H3/p+1