2-(3-ethylbenzimidazol-3-ium-1-yl)-3-(4-methylphenyl)sulfonylimino-4-oxidanylidene-naphthalen-1-olate

Systemtic Name: 2-(3-ethylbenzimidazol-3-ium-1-yl)-3-(4-methylphenyl)sulfonylimino-4-oxidanylidene-naphthalen-1-olate Openeye Name: 2-(3-ethylbenzimidazol-3-ium-1-yl)-4-oxo-3-(p-tolylsulfonylimino)naphthalen-1-olate CAS Name: 2-(3-ethyl-1-benzimidazol-3-iumyl)-3-(4-methylphenyl)sulfonylimino-4-oxo-1-naphthalenolate IUPAC Name: 2-(3-ethylbenzimidazol-3-ium-1-yl)-3-(4-methylphenyl)sulfonylimino-4-oxonaphthalen-1-olate Traditional Name: 2-(3-ethylbenzimidazol-3-ium-1-yl)-4-keto-3-tosylimino-naphthalen-1-olate Formula: C26H21N3O4S MolecularWeight: 471.52764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=CN(C2=CC=CC=C21)C3=C(C4=CC=CC=C4C(=O)C3=NS(=O)(=O)C5=CC=C(C=C5)C)[O-]

Isomeric SMILES

CC[N+]1=CN(C2=CC=CC=C21)C3=C(C4=CC=CC=C4C(=O)C3=NS(=O)(=O)C5=CC=C(C=C5)C)[O-]

InChI

InChI=1S/C26H21N3O4S/c1-3-28-16-29(22-11-7-6-10-21(22)28)24-23(25(30)19-8-4-5-9-20(19)26(24)31)27-34(32,33)18-14-12-17(2)13-15-18/h4-16H,3H2,1-2H3