2-(3-nitrophenyl)-5-(phenylcarbonyl)-1,2-thiazol-3-one

Systemtic Name: 2-(3-nitrophenyl)-5-(phenylcarbonyl)-1,2-thiazol-3-one Openeye Name: 5-benzoyl-2-(3-nitrophenyl)isothiazol-3-one CAS Name: 5-benzoyl-2-(3-nitrophenyl)-3-isothiazolone IUPAC Name: 5-benzoyl-2-(3-nitrophenyl)-1,2-thiazol-3-one Traditional Name: 5-benzoyl-2-(3-nitrophenyl)-4-isothiazolin-3-one Formula: C16H10N2O4S MolecularWeight: 326.3266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC(=O)N(S2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC(=O)N(S2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H10N2O4S/c19-15-10-14(16(20)11-5-2-1-3-6-11)23-17(15)12-7-4-8-13(9-12)18(21)22/h1-10H