ethyl N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]carbamate

Systemtic Name: ethyl N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]carbamate Openeye Name: ethyl N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]carbamate CAS Name: N-[1-methyl-2-(1-piperidin-1-iumylmethyl)-5-benzimidazolyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]carbamate Traditional Name: N-[1-methyl-2-(piperidin-1-ium-1-ylmethyl)benzimidazol-5-yl]carbamic acid ethyl ester Formula: C17H25N4O2+ MolecularWeight: 317.406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCCCC3)C

Isomeric SMILES

CCOC(=O)NC1=CC2=C(C=C1)N(C(=N2)C[NH+]3CCCCC3)C

InChI

InChI=1S/C17H24N4O2/c1-3-23-17(22)18-13-7-8-15-14(11-13)19-16(20(15)2)12-21-9-5-4-6-10-21/h7-8,11H,3-6,9-10,12H2,1-2H3,(H,18,22)/p+1