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

Systemtic Name: (3Z)-4-oxidanylidene-3-(phenylsulfonylimino)-2-(3-propan-2-ylimidazol-3-ium-1-yl)naphthalen-1-olate Openeye Name: (3Z)-3-(benzenesulfonylimino)-2-(3-isopropylimidazol-3-ium-1-yl)-4-oxo-naphthalen-1-olate CAS Name: (3Z)-3-(benzenesulfonylimino)-4-oxo-2-(3-propan-2-yl-1-imidazol-3-iumyl)-1-naphthalenolate IUPAC Name: (3Z)-3-(benzenesulfonylimino)-4-oxo-2-(3-propan-2-ylimidazol-3-ium-1-yl)naphthalen-1-olate Traditional Name: (3Z)-3-besylimino-2-(3-isopropylimidazol-3-ium-1-yl)-4-keto-naphthalen-1-olate Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[N+]1=CN(C=C1)C2=C(C3=CC=CC=C3C(=O)C2=NS(=O)(=O)C4=CC=CC=C4)[O-]

Isomeric SMILES

CC(C)[N+]1=CN(C=C1)C\2=C(C3=CC=CC=C3C(=O)/C2=N\S(=O)(=O)C4=CC=CC=C4)[O-]

InChI

InChI=1S/C22H19N3O4S/c1-15(2)24-12-13-25(14-24)20-19(23-30(28,29)16-8-4-3-5-9-16)21(26)17-10-6-7-11-18(17)22(20)27/h3-15H,1-2H3