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

Systemtic Name: N-methyl-1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-4-carboxamide Openeye Name: N-methyl-1-[1-(o-tolylmethyl)piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-carboxamide CAS Name: N-methyl-1-[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]-N-[[(2R)-2-oxanyl]methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-methyl-1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-[[(2R)-oxan-2-yl]methyl]piperidin-1-ium-4-carboxamide Traditional Name: N-methyl-1-[1-(2-methylbenzyl)piperidin-1-ium-4-yl]-N-[[(2R)-tetrahydropyran-2-yl]methyl]piperidin-1-ium-4-carboxamide Formula: C26H43N3O2+2 MolecularWeight: 429.63852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)N(C)CC4CCCCO4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)N(C)C[C@H]4CCCCO4

InChI

InChI=1S/C26H41N3O2/c1-21-7-3-4-8-23(21)19-28-14-12-24(13-15-28)29-16-10-22(11-17-29)26(30)27(2)20-25-9-5-6-18-31-25/h3-4,7-8,22,24-25H,5-6,9-20H2,1-2H3/p+2/t25-/m1/s1