N-methyl-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]-N-[(3S)-oxolan-3-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-methyl-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]-N-[(3S)-oxolan-3-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-methyl-1-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]-N-[(3S)-tetrahydrofuran-3-yl]piperidin-1-ium-4-carboxamide CAS Name: N-methyl-1-[1-[(6-methyl-2-pyridinyl)methyl]-4-piperidin-1-iumyl]-N-[(3S)-3-oxolanyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-methyl-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]-N-[(3S)-oxolan-3-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-methyl-1-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]-N-[(3S)-tetrahydrofuran-3-yl]piperidin-1-ium-4-carboxamide Formula: C23H38N4O2+2 MolecularWeight: 402.57342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)N(C)C4CCOC4

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)N(C)[C@H]4CCOC4

InChI

InChI=1S/C23H36N4O2/c1-18-4-3-5-20(24-18)16-26-11-8-21(9-12-26)27-13-6-19(7-14-27)23(28)25(2)22-10-15-29-17-22/h3-5,19,21-22H,6-17H2,1-2H3/p+2/t22-/m0/s1