2-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline; methyl sulfate

Systemtic Name: 2-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline; methyl sulfate Openeye Name: 2-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methyleneamino]aniline; methyl sulfate CAS Name: 2-methyl-N-[(E)-(1-methyl-4-pyridin-1-iumyl)methylideneamino]aniline; methyl sulfate IUPAC Name: 2-methyl-N-[(E)-(1-methylpyridin-1-ium-4-yl)methylideneamino]aniline; methyl sulfate Traditional Name: [(E)-(1-methylpyridin-1-ium-4-yl)methyleneamino]-(o-tolyl)amine; methyl sulfate Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NN=CC2=CC=[N+](C=C2)C.COS(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N/N=C/C2=CC=[N+](C=C2)C.COS(=O)(=O)[O-]

InChI

InChI=1S/C14H15N3.CH4O4S/c1-12-5-3-4-6-14(12)16-15-11-13-7-9-17(2)10-8-13;1-5-6(2,3)4/h3-11H,1-2H3;1H3,(H,2,3,4)