2-(4-methoxyphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-4H-pyrrolo[1,2-a]benzimidazol-4-ium dichloride

Systemtic Name: 2-(4-methoxyphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-4H-pyrrolo[1,2-a]benzimidazol-4-ium dichloride Openeye Name: 2-(4-methoxyphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-4H-pyrrolo[1,2-a]benzimidazol-4-ium dichloride CAS Name: 2-(4-methoxyphenyl)-4-[2-(1-piperidin-1-iumyl)ethyl]-4H-pyrrolo[1,2-a]benzimidazol-4-ium dichloride IUPAC Name: 2-(4-methoxyphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-4H-pyrrolo[1,2-a]benzimidazol-4-ium dichloride Traditional Name: 2-(4-methoxyphenyl)-4-(2-piperidin-1-ium-1-ylethyl)-4H-pyrrolo[1,2-a]benzimidazol-4-ium dichloride Formula: C24H29Cl2N3O MolecularWeight: 446.41256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CN3C4=CC=CC=C4[NH+](C3=C2)CC[NH+]5CCCCC5.[Cl-].[Cl-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CN3C4=CC=CC=C4[NH+](C3=C2)CC[NH+]5CCCCC5.[Cl-].[Cl-]

InChI

InChI=1S/C24H27N3O.2ClH/c1-28-21-11-9-19(10-12-21)20-17-24-26(16-15-25-13-5-2-6-14-25)22-7-3-4-8-23(22)27(24)18-20;;/h3-4,7-12,17-18H,2,5-6,13-16H2,1H3;2*1H