N-(3-azanyl-1H-isoindol-2-ium-2-yl)-1-ethyl-2-methyl-benzimidazole-5-carboxamide

Systemtic Name: N-(3-azanyl-1H-isoindol-2-ium-2-yl)-1-ethyl-2-methyl-benzimidazole-5-carboxamide Openeye Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-1-ethyl-2-methyl-benzimidazole-5-carboxamide CAS Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-1-ethyl-2-methyl-5-benzimidazolecarboxamide IUPAC Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-1-ethyl-2-methylbenzimidazole-5-carboxamide Traditional Name: N-(3-amino-1H-isoindol-2-ium-2-yl)-1-ethyl-2-methyl-benzimidazole-5-carboxamide Formula: C19H20N5O+ MolecularWeight: 334.395

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NC2=C1C=CC(=C2)C(=O)N[N+]3=C(C4=CC=CC=C4C3)N)C

Isomeric SMILES

CCN1C(=NC2=C1C=CC(=C2)C(=O)N[N+]3=C(C4=CC=CC=C4C3)N)C

InChI

InChI=1S/C19H19N5O/c1-3-23-12(2)21-16-10-13(8-9-17(16)23)19(25)22-24-11-14-6-4-5-7-15(14)18(24)20/h4-10,20H,3,11H2,1-2H3,(H,22,25)/p+1