3-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[2-(4-methylsulfonylphenyl)-2-oxidanylidene-ethyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[2-(4-methylsulfonylphenyl)-2-oxo-ethyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[2-(4-methylsulfonylphenyl)-2-oxoethyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[2-keto-2-(4-mesylphenyl)ethyl]-1,2,3-benzotriazin-4-one Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3N=N2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C(=O)CN2C(=O)C3=CC=CC=C3N=N2

InChI

InChI=1S/C16H13N3O4S/c1-24(22,23)12-8-6-11(7-9-12)15(20)10-19-16(21)13-4-2-3-5-14(13)17-18-19/h2-9H,10H2,1H3