4-methyl-2-(4-nitrophenyl)-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one

Systemtic Name: 4-methyl-2-(4-nitrophenyl)-1,1-bis(oxidanylidene)-5-phenyl-1,2-thiazol-3-one Openeye Name: 4-methyl-2-(4-nitrophenyl)-1,1-dioxo-5-phenyl-isothiazol-3-one CAS Name: 4-methyl-2-(4-nitrophenyl)-1,1-dioxo-5-phenyl-3-isothiazolone IUPAC Name: 4-methyl-2-(4-nitrophenyl)-1,1-dioxo-5-phenyl-1,2-thiazol-3-one Traditional Name: 1,1-diketo-4-methyl-2-(4-nitrophenyl)-5-phenyl-isothiazol-3-one Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(S(=O)(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=C(S(=O)(=O)N(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C16H12N2O5S/c1-11-15(12-5-3-2-4-6-12)24(22,23)17(16(11)19)13-7-9-14(10-8-13)18(20)21/h2-10H,1H3