6-chloranyl-3-[1,4-dimethyl-1-[4-(1-methyl-2-oxidanylidene-3H-benzimidazol-1-ium-1-yl)butyl]piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one

Systemtic Name: 6-chloranyl-3-[1,4-dimethyl-1-[4-(1-methyl-2-oxidanylidene-3H-benzimidazol-1-ium-1-yl)butyl]piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one Openeye Name: 6-chloro-3-[1,4-dimethyl-1-[4-(1-methyl-2-oxo-3H-benzimidazol-1-ium-1-yl)butyl]piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one CAS Name: 6-chloro-3-[1,4-dimethyl-1-[4-(1-methyl-2-oxo-3H-benzimidazol-1-ium-1-yl)butyl]-4-piperidin-1-iumyl]-3-methyl-1H-benzimidazol-3-ium-2-one IUPAC Name: 6-chloro-3-[1,4-dimethyl-1-[4-(1-methyl-2-oxo-3H-benzimidazol-1-ium-1-yl)butyl]piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one Traditional Name: 6-chloro-3-[1-[4-(2-keto-1-methyl-3H-benzimidazol-1-ium-1-yl)butyl]-1,4-dimethyl-piperidin-1-ium-4-yl]-3-methyl-1H-benzimidazol-3-ium-2-one Formula: C27H37ClN5O2+3 MolecularWeight: 499.06798

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC[N+](CC1)(C)CCCC[N+]2(C3=CC=CC=C3NC2=O)C)[N+]4(C5=C(C=C(C=C5)Cl)NC4=O)C

Isomeric SMILES

CC1(CC[N+](CC1)(C)CCCC[N+]2(C3=CC=CC=C3NC2=O)C)[N+]4(C5=C(C=C(C=C5)Cl)NC4=O)C

InChI

InChI=1S/C27H35ClN5O2/c1-27(33(4)24-12-11-20(28)19-22(24)30-26(33)35)13-17-31(2,18-14-27)15-7-8-16-32(3)23-10-6-5-9-21(23)29-25(32)34/h5-6,9-12,19H,7-8,13-18H2,1-4H3/q+1/p+2