6-chloranyl-2-[(1S)-1-piperazin-4-ium-1-ylethyl]-1H-benzimidazole

Systemtic Name: 6-chloranyl-2-[(1S)-1-piperazin-4-ium-1-ylethyl]-1H-benzimidazole Openeye Name: 6-chloro-2-[(1S)-1-piperazin-4-ium-1-ylethyl]-1H-benzimidazole CAS Name: 6-chloro-2-[(1S)-1-(1-piperazin-4-iumyl)ethyl]-1H-benzimidazole IUPAC Name: 6-chloro-2-[(1S)-1-piperazin-4-ium-1-ylethyl]-1H-benzimidazole Traditional Name: 6-chloro-2-[(1S)-1-piperazin-4-ium-1-ylethyl]-1H-benzimidazole Formula: C13H18ClN4+ MolecularWeight: 265.76182

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(N1)C=C(C=C2)Cl)N3CC[NH2+]CC3

Isomeric SMILES

C[C@@H](C1=NC2=C(N1)C=C(C=C2)Cl)N3CC[NH2+]CC3

InChI

InChI=1S/C13H17ClN4/c1-9(18-6-4-15-5-7-18)13-16-11-3-2-10(14)8-12(11)17-13/h2-3,8-9,15H,4-7H2,1H3,(H,16,17)/p+1/t9-/m0/s1