7-chloranyl-5-nitro-2-oxidanyl-3-(3-phenylpropylsulfanyl)-1H-quinolin-4-one

Systemtic Name: 7-chloranyl-5-nitro-2-oxidanyl-3-(3-phenylpropylsulfanyl)-1H-quinolin-4-one Openeye Name: 7-chloro-2-hydroxy-5-nitro-3-(3-phenylpropylsulfanyl)-1H-quinolin-4-one CAS Name: 7-chloro-2-hydroxy-5-nitro-3-(3-phenylpropylthio)-1H-quinolin-4-one IUPAC Name: 7-chloro-2-hydroxy-5-nitro-3-(3-phenylpropylsulfanyl)-1H-quinolin-4-one Traditional Name: 7-chloro-2-hydroxy-5-nitro-3-(3-phenylpropylthio)-4-quinolone Formula: C18H15ClN2O4S MolecularWeight: 390.8407

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCSC2=C(NC3=CC(=CC(=C3C2=O)[N+](=O)[O-])Cl)O

Isomeric SMILES

C1=CC=C(C=C1)CCCSC2=C(NC3=CC(=CC(=C3C2=O)[N+](=O)[O-])Cl)O

InChI

InChI=1S/C18H15ClN2O4S/c19-12-9-13-15(14(10-12)21(24)25)16(22)17(18(23)20-13)26-8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9-10H,4,7-8H2,(H2,20,22,23)