(3Z)-4-oxidanylidene-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]-3-(phenylsulfonylimino)naphthalen-1-olate

Systemtic Name: (3Z)-4-oxidanylidene-2-[4-(phenylmethyl)pyridin-1-ium-1-yl]-3-(phenylsulfonylimino)naphthalen-1-olate Openeye Name: (3Z)-3-(benzenesulfonylimino)-2-(4-benzylpyridin-1-ium-1-yl)-4-oxo-naphthalen-1-olate CAS Name: (3Z)-3-(benzenesulfonylimino)-4-oxo-2-[4-(phenylmethyl)-1-pyridin-1-iumyl]-1-naphthalenolate IUPAC Name: (3Z)-3-(benzenesulfonylimino)-2-(4-benzylpyridin-1-ium-1-yl)-4-oxonaphthalen-1-olate Traditional Name: (3Z)-2-(4-benzylpyridin-1-ium-1-yl)-3-besylimino-4-keto-naphthalen-1-olate Formula: C28H20N2O4S MolecularWeight: 480.5344

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C3=C(C4=CC=CC=C4C(=O)C3=NS(=O)(=O)C5=CC=CC=C5)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC2=CC=[N+](C=C2)C\3=C(C4=CC=CC=C4C(=O)/C3=N\S(=O)(=O)C5=CC=CC=C5)[O-]

InChI

InChI=1S/C28H20N2O4S/c31-27-23-13-7-8-14-24(23)28(32)26(25(27)29-35(33,34)22-11-5-2-6-12-22)30-17-15-21(16-18-30)19-20-9-3-1-4-10-20/h1-18H,19H2