cyclobutyl-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: cyclobutyl-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: cyclobutyl-[[1-(o-tolylmethyl)piperidin-1-ium-4-yl]methyl]-(3-pyridylmethyl)ammonium CAS Name: cyclobutyl-[[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: cyclobutyl-[[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: cyclobutyl-[[1-(2-methylbenzyl)piperidin-1-ium-4-yl]methyl]-(3-pyridylmethyl)ammonium Formula: C24H35N3+2 MolecularWeight: 365.5548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)C4CCC4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)C[NH+](CC3=CN=CC=C3)C4CCC4

InChI

InChI=1S/C24H33N3/c1-20-6-2-3-8-23(20)19-26-14-11-21(12-15-26)17-27(24-9-4-10-24)18-22-7-5-13-25-16-22/h2-3,5-8,13,16,21,24H,4,9-12,14-15,17-19H2,1H3/p+2