5-chloranyl-2-(4-nitrophenyl)-1,2-thiazol-3-one

Systemtic Name: 5-chloranyl-2-(4-nitrophenyl)-1,2-thiazol-3-one Openeye Name: 5-chloro-2-(4-nitrophenyl)isothiazol-3-one CAS Name: 5-chloro-2-(4-nitrophenyl)-3-isothiazolone IUPAC Name: 5-chloro-2-(4-nitrophenyl)-1,2-thiazol-3-one Traditional Name: 5-chloro-2-(4-nitrophenyl)-4-isothiazolin-3-one Formula: C9H5ClN2O3S MolecularWeight: 256.6656

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C=C(S2)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C=C(S2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C9H5ClN2O3S/c10-8-5-9(13)11(16-8)6-1-3-7(4-2-6)12(14)15/h1-5H