6-chloranyl-3-oxidanidyl-3-[1-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-3-ium-2-one

Systemtic Name: 6-chloranyl-3-oxidanidyl-3-[1-[3-(2-oxidanylidene-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-3-ium-2-one Openeye Name: 6-chloro-3-oxido-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]-4-piperidyl]-1H-benzimidazol-3-ium-2-one CAS Name: 6-chloro-3-oxido-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]-4-piperidinyl]-1H-benzimidazol-3-ium-2-one IUPAC Name: 6-chloro-3-oxido-3-[1-[3-(2-oxo-3H-benzimidazol-1-yl)propyl]piperidin-4-yl]-1H-benzimidazol-3-ium-2-one Traditional Name: 6-chloro-3-[1-[3-(2-keto-3H-benzimidazol-1-yl)propyl]-4-piperidyl]-3-oxido-1H-benzimidazol-3-ium-2-one Formula: C22H24ClN5O3 MolecularWeight: 441.91066

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[N+]2(C3=C(C=C(C=C3)Cl)NC2=O)[O-])CCCN4C5=CC=CC=C5NC4=O

Isomeric SMILES

C1CN(CCC1[N+]2(C3=C(C=C(C=C3)Cl)NC2=O)[O-])CCCN4C5=CC=CC=C5NC4=O

InChI

InChI=1S/C22H24ClN5O3/c23-15-6-7-20-18(14-15)25-22(30)28(20,31)16-8-12-26(13-9-16)10-3-11-27-19-5-2-1-4-17(19)24-21(27)29/h1-2,4-7,14,16H,3,8-13H2,(H,24,29)(H,25,30)