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

Systemtic Name: 1-[4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]ethanone Openeye Name: 1-[4-[4-(o-tolylmethyl)piperazin-4-ium-1-carbonyl]-1-piperidyl]ethanone CAS Name: 1-[4-[[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-1-piperidinyl]ethanone IUPAC Name: 1-[4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-carbonyl]piperidin-1-yl]ethanone Traditional Name: 1-[4-[4-(2-methylbenzyl)piperazin-4-ium-1-carbonyl]piperidino]ethanone Formula: C20H30N3O2+ MolecularWeight: 344.4711

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)C

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C3CCN(CC3)C(=O)C

InChI

InChI=1S/C20H29N3O2/c1-16-5-3-4-6-19(16)15-21-11-13-23(14-12-21)20(25)18-7-9-22(10-8-18)17(2)24/h3-6,18H,7-15H2,1-2H3/p+1