(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-oxidanylidene-3H-benzimidazole-1-carboxylate hydrochloride

Systemtic Name: (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-oxidanylidene-3H-benzimidazole-1-carboxylate hydrochloride Openeye Name: (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-oxo-3H-benzimidazole-1-carboxylate hydrochloride CAS Name: 2-oxo-3H-benzimidazole-1-carboxylic acid (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) ester hydrochloride IUPAC Name: (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-oxo-3H-benzimidazole-1-carboxylate hydrochloride Traditional Name: 2-keto-3H-benzimidazole-1-carboxylic acid (9-methyl-9-azabicyclo[3.3.1]nonan-3-yl) ester hydrochloride Formula: C17H22ClN3O3 MolecularWeight: 351.82788

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCCC1CC(C2)OC(=O)N3C4=CC=CC=C4NC3=O.Cl

Isomeric SMILES

CN1C2CCCC1CC(C2)OC(=O)N3C4=CC=CC=C4NC3=O.Cl

InChI

InChI=1S/C17H21N3O3.ClH/c1-19-11-5-4-6-12(19)10-13(9-11)23-17(22)20-15-8-3-2-7-14(15)18-16(20)21;/h2-3,7-8,11-13H,4-6,9-10H2,1H3,(H,18,21);1H