(3Z)-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxidanylidene-3-(phenylsulfonylimino)naphthalen-1-olate

Systemtic Name: (3Z)-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxidanylidene-3-(phenylsulfonylimino)naphthalen-1-olate Openeye Name: (3Z)-3-(benzenesulfonylimino)-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxo-naphthalen-1-olate CAS Name: (3Z)-3-(benzenesulfonylimino)-2-(3-methyl-1-benzimidazol-3-iumyl)-4-oxo-1-naphthalenolate IUPAC Name: (3Z)-3-(benzenesulfonylimino)-2-(3-methylbenzimidazol-3-ium-1-yl)-4-oxonaphthalen-1-olate Traditional Name: (3Z)-3-besylimino-4-keto-2-(3-methylbenzimidazol-3-ium-1-yl)naphthalen-1-olate Formula: C24H17N3O4S MolecularWeight: 443.47448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[N+]1=CN(C2=CC=CC=C21)C\3=C(C4=CC=CC=C4C(=O)/C3=N\S(=O)(=O)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C24H17N3O4S/c1-26-15-27(20-14-8-7-13-19(20)26)22-21(25-32(30,31)16-9-3-2-4-10-16)23(28)17-11-5-6-12-18(17)24(22)29/h2-15H,1H3