2-[2-azanyl-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone

Systemtic Name: 2-[2-azanyl-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone Openeye Name: 2-[2-amino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone CAS Name: 2-[2-amino-3-[2-(1-piperidin-1-iumyl)ethyl]-1-benzimidazol-1-iumyl]-1-(3,4-dichlorophenyl)ethanone IUPAC Name: 2-[2-amino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone Traditional Name: 2-[2-amino-3-(2-piperidin-1-ium-1-ylethyl)benzimidazol-1-ium-1-yl]-1-(3,4-dichlorophenyl)ethanone Formula: C22H26Cl2N4O+2 MolecularWeight: 433.37404

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCN2C3=CC=CC=C3[N+](=C2N)CC(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CC[NH+](CC1)CCN2C3=CC=CC=C3[N+](=C2N)CC(=O)C4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H24Cl2N4O/c23-17-9-8-16(14-18(17)24)21(29)15-28-20-7-3-2-6-19(20)27(22(28)25)13-12-26-10-4-1-5-11-26/h2-3,6-9,14,25H,1,4-5,10-13,15H2/p+2