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

Systemtic Name: 1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-(2-methylpropyl)piperidin-1-ium-4-carboxamide Openeye Name: N-isobutyl-1-[1-(o-tolylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide CAS Name: 1-[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]-N-(2-methylpropyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-(2-methylpropyl)piperidin-1-ium-4-carboxamide Traditional Name: N-isobutyl-1-[1-(2-methylbenzyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Formula: C23H39N3O+2 MolecularWeight: 373.57526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)NCC(C)C

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)NCC(C)C

InChI

InChI=1S/C23H37N3O/c1-18(2)16-24-23(27)20-8-14-26(15-9-20)22-10-12-25(13-11-22)17-21-7-5-4-6-19(21)3/h4-7,18,20,22H,8-17H2,1-3H3,(H,24,27)/p+2