2-isoquinolin-2-ium-2-yl-N-(4-phenyldiazenylphenyl)ethanamide chloride

Systemtic Name: 2-isoquinolin-2-ium-2-yl-N-(4-phenyldiazenylphenyl)ethanamide chloride Openeye Name: 2-isoquinolin-2-ium-2-yl-N-(4-phenylazophenyl)acetamide chloride CAS Name: 2-(2-isoquinolin-2-iumyl)-N-(4-phenyldiazenylphenyl)acetamide chloride IUPAC Name: 2-isoquinolin-2-ium-2-yl-N-(4-phenyldiazenylphenyl)acetamide chloride Traditional Name: 2-isoquinolin-2-ium-2-yl-N-(4-phenylazophenyl)acetamide chloride Formula: C23H19ClN4O MolecularWeight: 402.87616

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)C[N+]3=CC4=CC=CC=C4C=C3.[Cl-]

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=CC=C(C=C2)NC(=O)C[N+]3=CC4=CC=CC=C4C=C3.[Cl-]

InChI

InChI=1S/C23H18N4O.ClH/c28-23(17-27-15-14-18-6-4-5-7-19(18)16-27)24-20-10-12-22(13-11-20)26-25-21-8-2-1-3-9-21;/h1-16H,17H2;1H