8-chloranyl-3-ethanoyl-2-methylsulfanyl-5-nitro-1H-quinolin-4-one

Systemtic Name: 8-chloranyl-3-ethanoyl-2-methylsulfanyl-5-nitro-1H-quinolin-4-one Openeye Name: 3-acetyl-8-chloro-2-methylsulfanyl-5-nitro-1H-quinolin-4-one CAS Name: 3-acetyl-8-chloro-2-(methylthio)-5-nitro-1H-quinolin-4-one IUPAC Name: 3-acetyl-8-chloro-2-methylsulfanyl-5-nitro-1H-quinolin-4-one Traditional Name: 3-acetyl-8-chloro-2-(methylthio)-5-nitro-4-quinolone Formula: C12H9ClN2O4S MolecularWeight: 312.72886

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC2=C(C=CC(=C2C1=O)[N+](=O)[O-])Cl)SC

Isomeric SMILES

CC(=O)C1=C(NC2=C(C=CC(=C2C1=O)[N+](=O)[O-])Cl)SC

InChI

InChI=1S/C12H9ClN2O4S/c1-5(16)8-11(17)9-7(15(18)19)4-3-6(13)10(9)14-12(8)20-2/h3-4H,1-2H3,(H,14,17)