(E)-methylsulfonylimino-[(4-methylsulfonylphenyl)amino]-(8-sulfonaphthalen-2-yl)azanium

Systemtic Name: (E)-methylsulfonylimino-[(4-methylsulfonylphenyl)amino]-(8-sulfonaphthalen-2-yl)azanium Openeye Name: (E)-(4-methylsulfonylanilino)-methylsulfonylimino-(8-sulfo-2-naphthyl)ammonium CAS Name: (E)-(4-methylsulfonylanilino)-methylsulfonylimino-(8-sulfo-2-naphthalenyl)ammonium IUPAC Name: (E)-(4-methylsulfonylanilino)-methylsulfonylimino-(8-sulfonaphthalen-2-yl)azanium Traditional Name: (E)-(4-mesylanilino)-mesylimino-(8-sulfo-2-naphthyl)ammonium Formula: C18H18N3O7S3+ MolecularWeight: 484.54642

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N[N+](=NS(=O)(=O)C)C2=CC3=C(C=CC=C3S(=O)(=O)O)C=C2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N/[N+](=N/S(=O)(=O)C)/C2=CC3=C(C=CC=C3S(=O)(=O)O)C=C2

InChI

InChI=1S/C18H17N3O7S3/c1-29(22,23)16-10-7-14(8-11-16)19-21(20-30(2,24)25)15-9-6-13-4-3-5-18(17(13)12-15)31(26,27)28/h3-12H,1-2H3,(H-,19,20,26,27,28)/p+1