methyl 1-[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-oxidanylidene-2-[(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-oxo-2-[(2-oxo-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-[(2-keto-1,3-dihydrobenzimidazol-5-yl)amino]ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C16H21N4O4+ MolecularWeight: 333.36234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC[NH+](CC1)CC(=O)NC2=CC3=C(C=C2)NC(=O)N3

Isomeric SMILES

COC(=O)C1CC[NH+](CC1)CC(=O)NC2=CC3=C(C=C2)NC(=O)N3

InChI

InChI=1S/C16H20N4O4/c1-24-15(22)10-4-6-20(7-5-10)9-14(21)17-11-2-3-12-13(8-11)19-16(23)18-12/h2-3,8,10H,4-7,9H2,1H3,(H,17,21)(H2,18,19,23)/p+1