N-[5-azanyl-4-(1,3-dimethylbenzimidazol-3-ium-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]-3,4-dimethoxy-benzamide chloride

Systemtic Name: N-[5-azanyl-4-(1,3-dimethylbenzimidazol-3-ium-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]-3,4-dimethoxy-benzamide chloride Openeye Name: N-[5-amino-4-(1,3-dimethylbenzimidazol-3-ium-2-yl)-3-oxo-2H-pyrrol-1-yl]-3,4-dimethoxy-benzamide chloride CAS Name: N-[5-amino-4-(1,3-dimethyl-2-benzimidazol-3-iumyl)-3-oxo-2H-pyrrol-1-yl]-3,4-dimethoxybenzamide chloride IUPAC Name: N-[5-amino-4-(1,3-dimethylbenzimidazol-3-ium-2-yl)-3-oxo-2H-pyrrol-1-yl]-3,4-dimethoxybenzamide chloride Traditional Name: N-[2-amino-3-(1,3-dimethylbenzimidazol-3-ium-2-yl)-4-keto-2-pyrrolin-1-yl]-3,4-dimethoxy-benzamide chloride Formula: C22H24ClN5O4 MolecularWeight: 457.91006

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2[N+](=C1C3=C(N(CC3=O)NC(=O)C4=CC(=C(C=C4)OC)OC)N)C.[Cl-]

Isomeric SMILES

CN1C2=CC=CC=C2[N+](=C1C3=C(N(CC3=O)NC(=O)C4=CC(=C(C=C4)OC)OC)N)C.[Cl-]

InChI

InChI=1S/C22H23N5O4.ClH/c1-25-14-7-5-6-8-15(14)26(2)22(25)19-16(28)12-27(20(19)23)24-21(29)13-9-10-17(30-3)18(11-13)31-4;/h5-11,23H,12H2,1-4H3,(H,24,29);1H