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

Systemtic Name: N-methyl-1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-propan-2-yl-piperidin-1-ium-4-carboxamide Openeye Name: N-isopropyl-N-methyl-1-[1-(o-tolylmethyl)piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide CAS Name: N-methyl-1-[1-[(2-methylphenyl)methyl]-4-piperidin-1-iumyl]-N-propan-2-yl-4-piperidin-1-iumcarboxamide IUPAC Name: N-methyl-1-[1-[(2-methylphenyl)methyl]piperidin-1-ium-4-yl]-N-propan-2-ylpiperidin-1-ium-4-carboxamide Traditional Name: N-isopropyl-N-methyl-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)N(C)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H37N3O/c1-18(2)24(4)23(27)20-9-15-26(16-10-20)22-11-13-25(14-12-22)17-21-8-6-5-7-19(21)3/h5-8,18,20,22H,9-17H2,1-4H3/p+2