4-methylbenzenesulfonate; (1E)-1-[(1-methylpyridin-1-ium-3-yl)hydrazinylidene]naphthalen-2-one

Systemtic Name: 4-methylbenzenesulfonate; (1E)-1-[(1-methylpyridin-1-ium-3-yl)hydrazinylidene]naphthalen-2-one Openeye Name: 4-methylbenzenesulfonate; (1E)-1-[(1-methylpyridin-1-ium-3-yl)hydrazono]naphthalen-2-one CAS Name: 4-methylbenzenesulfonate; (1E)-1-[(1-methyl-3-pyridin-1-iumyl)hydrazinylidene]-2-naphthalenone IUPAC Name: 4-methylbenzenesulfonate; (1E)-1-[(1-methylpyridin-1-ium-3-yl)hydrazinylidene]naphthalen-2-one Traditional Name: (1E)-1-[(1-methylpyridin-1-ium-3-yl)hydrazono]naphthalen-2-one tosylate Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)NN=C2C(=O)C=CC3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+]1=CC=CC(=C1)N/N=C\2/C(=O)C=CC3=CC=CC=C32

InChI

InChI=1S/C16H13N3O.C7H8O3S/c1-19-10-4-6-13(11-19)17-18-16-14-7-3-2-5-12(14)8-9-15(16)20;1-6-2-4-7(5-3-6)11(8,9)10/h2-11H,1H3;2-5H,1H3,(H,8,9,10)