(1Z)-1-[(1-methylpyridin-1-ium-3-yl)hydrazinylidene]naphthalen-2-one; methyl sulfate

Systemtic Name: (1Z)-1-[(1-methylpyridin-1-ium-3-yl)hydrazinylidene]naphthalen-2-one; methyl sulfate Openeye Name: (1Z)-1-[(1-methylpyridin-1-ium-3-yl)hydrazono]naphthalen-2-one; methyl sulfate CAS Name: (1Z)-1-[(1-methyl-3-pyridin-1-iumyl)hydrazinylidene]-2-naphthalenone; methyl sulfate IUPAC Name: (1Z)-1-[(1-methylpyridin-1-ium-3-yl)hydrazinylidene]naphthalen-2-one; methyl sulfate Traditional Name: (1Z)-1-[(1-methylpyridin-1-ium-3-yl)hydrazono]naphthalen-2-one; methyl sulfate Formula: C17H17N3O5S MolecularWeight: 375.39898

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)NN=C2C(=O)C=CC3=CC=CC=C32.COS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)N/N=C/2\C(=O)C=CC3=CC=CC=C32.COS(=O)(=O)[O-]

InChI

InChI=1S/C16H13N3O.CH4O4S/c1-19-10-4-6-13(11-19)17-18-16-14-7-3-2-5-12(14)8-9-15(16)20;1-5-6(2,3)4/h2-11H,1H3;1H3,(H,2,3,4)