1-(2-azanyl-2-oxidanylidene-ethyl)-N-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(2-azanyl-2-oxidanylidene-ethyl)-N-[(6-chloranyl-1H-benzimidazol-2-yl)methyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-(2-amino-2-oxo-ethyl)-N-[(6-chloro-1H-benzimidazol-2-yl)methyl]piperidin-1-ium-4-carboxamide CAS Name: 1-(2-amino-2-oxoethyl)-N-[(6-chloro-1H-benzimidazol-2-yl)methyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(2-amino-2-oxoethyl)-N-[(6-chloro-1H-benzimidazol-2-yl)methyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-(2-amino-2-keto-ethyl)-N-[(6-chloro-1H-benzimidazol-2-yl)methyl]piperidin-1-ium-4-carboxamide Formula: C16H21ClN5O2+ MolecularWeight: 350.82324

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NCC2=NC3=C(N2)C=C(C=C3)Cl)CC(=O)N

Isomeric SMILES

C1C[NH+](CCC1C(=O)NCC2=NC3=C(N2)C=C(C=C3)Cl)CC(=O)N

InChI

InChI=1S/C16H20ClN5O2/c17-11-1-2-12-13(7-11)21-15(20-12)8-19-16(24)10-3-5-22(6-4-10)9-14(18)23/h1-2,7,10H,3-6,8-9H2,(H2,18,23)(H,19,24)(H,20,21)/p+1