8-methyl-5-nitro-6-(phenylsulfonyl)quinoline

Systemtic Name: 8-methyl-5-nitro-6-(phenylsulfonyl)quinoline Openeye Name: 6-(benzenesulfonyl)-8-methyl-5-nitro-quinoline CAS Name: 6-(benzenesulfonyl)-8-methyl-5-nitroquinoline IUPAC Name: 6-(benzenesulfonyl)-8-methyl-5-nitroquinoline Traditional Name: 6-besyl-8-methyl-5-nitro-quinoline Formula: C16H12N2O4S MolecularWeight: 328.34248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1N=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC(=C(C2=C1N=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C16H12N2O4S/c1-11-10-14(23(21,22)12-6-3-2-4-7-12)16(18(19)20)13-8-5-9-17-15(11)13/h2-10H,1H3