7-(2-methoxyethanoylamino)-1-methyl-N-[[1-(2-methylpropyl)piperidin-1-ium-4-yl]methyl]-2-pyridin-3-yl-benzimidazole-5-carboxamide

Systemtic Name: 7-(2-methoxyethanoylamino)-1-methyl-N-[[1-(2-methylpropyl)piperidin-1-ium-4-yl]methyl]-2-pyridin-3-yl-benzimidazole-5-carboxamide Openeye Name: N-[(1-isobutylpiperidin-1-ium-4-yl)methyl]-7-[(2-methoxyacetyl)amino]-1-methyl-2-(3-pyridyl)benzimidazole-5-carboxamide CAS Name: 7-[(2-methoxy-1-oxoethyl)amino]-1-methyl-N-[[1-(2-methylpropyl)-4-piperidin-1-iumyl]methyl]-2-(3-pyridinyl)-5-benzimidazolecarboxamide IUPAC Name: 7-[(2-methoxyacetyl)amino]-1-methyl-N-[[1-(2-methylpropyl)piperidin-1-ium-4-yl]methyl]-2-pyridin-3-ylbenzimidazole-5-carboxamide Traditional Name: N-[(1-isobutylpiperidin-1-ium-4-yl)methyl]-7-[(2-methoxyacetyl)amino]-1-methyl-2-(3-pyridyl)benzimidazole-5-carboxamide Formula: C27H37N6O3+ MolecularWeight: 493.62108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(CC1)CNC(=O)C2=CC3=C(C(=C2)NC(=O)COC)N(C(=N3)C4=CN=CC=C4)C

Isomeric SMILES

CC(C)C[NH+]1CCC(CC1)CNC(=O)C2=CC3=C(C(=C2)NC(=O)COC)N(C(=N3)C4=CN=CC=C4)C

InChI

InChI=1S/C27H36N6O3/c1-18(2)16-33-10-7-19(8-11-33)14-29-27(35)21-12-22(30-24(34)17-36-4)25-23(13-21)31-26(32(25)3)20-6-5-9-28-15-20/h5-6,9,12-13,15,18-19H,7-8,10-11,14,16-17H2,1-4H3,(H,29,35)(H,30,34)/p+1