(7-fluoranyl-2-methyl-quinolin-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (7-fluoranyl-2-methyl-quinolin-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (7-fluoro-2-methyl-3-quinolyl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (7-fluoro-2-methyl-3-quinolinyl)-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (7-fluoro-2-methylquinolin-3-yl)-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (7-fluoro-2-methyl-3-quinolyl)-[4-(2-nitrophenyl)sulfonylpiperazino]methanone Formula: C21H19FN4O5S MolecularWeight: 458.462763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C2C=CC(=CC2=N1)F)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H19FN4O5S/c1-14-17(12-15-6-7-16(22)13-18(15)23-14)21(27)24-8-10-25(11-9-24)32(30,31)20-5-3-2-4-19(20)26(28)29/h2-7,12-13H,8-11H2,1H3