8-(2-methylphenyl)sulfanyl-5-nitro-quinoline

Systemtic Name: 8-(2-methylphenyl)sulfanyl-5-nitro-quinoline Openeye Name: 5-nitro-8-(o-tolylsulfanyl)quinoline CAS Name: 8-[(2-methylphenyl)thio]-5-nitroquinoline IUPAC Name: 8-(2-methylphenyl)sulfanyl-5-nitroquinoline Traditional Name: 5-nitro-8-(o-tolylthio)quinoline Formula: C16H12N2O2S MolecularWeight: 296.34368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

Isomeric SMILES

CC1=CC=CC=C1SC2=C3C(=C(C=C2)[N+](=O)[O-])C=CC=N3

InChI

InChI=1S/C16H12N2O2S/c1-11-5-2-3-7-14(11)21-15-9-8-13(18(19)20)12-6-4-10-17-16(12)15/h2-10H,1H3