1-[(6-chloranyl-1,3-dimethyl-benzimidazol-3-ium-4-yl)diazenyl]-2H-isoquinolin-3-one

Systemtic Name: 1-[(6-chloranyl-1,3-dimethyl-benzimidazol-3-ium-4-yl)diazenyl]-2H-isoquinolin-3-one Openeye Name: 1-(6-chloro-1,3-dimethyl-benzimidazol-3-ium-4-yl)azo-2H-isoquinolin-3-one CAS Name: 1-[(6-chloro-1,3-dimethyl-4-benzimidazol-3-iumyl)azo]-2H-isoquinolin-3-one IUPAC Name: 1-[(6-chloro-1,3-dimethylbenzimidazol-3-ium-4-yl)diazenyl]-2H-isoquinolin-3-one Traditional Name: 1-(6-chloro-1,3-dimethyl-benzimidazol-3-ium-4-yl)azo-3-isoquinolone Formula: C18H15ClN5O+ MolecularWeight: 352.7976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=[N+](C2=C1C=C(C=C2N=NC3=C4C=CC=CC4=CC(=O)N3)Cl)C

Isomeric SMILES

CN1C=[N+](C2=C1C=C(C=C2N=NC3=C4C=CC=CC4=CC(=O)N3)Cl)C

InChI

InChI=1S/C18H14ClN5O/c1-23-10-24(2)17-14(8-12(19)9-15(17)23)21-22-18-13-6-4-3-5-11(13)7-16(25)20-18/h3-10H,1-2H3/p+1