(6-chloranyl-2-methyl-quinolin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (6-chloranyl-2-methyl-quinolin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (6-chloro-2-methyl-3-quinolyl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (6-chloro-2-methyl-3-quinolinyl)-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (6-chloro-2-methylquinolin-3-yl)-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (6-chloro-2-methyl-3-quinolyl)-[4-(3-nitrophenyl)sulfonylpiperazino]methanone Formula: C21H19ClN4O5S MolecularWeight: 474.91736

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN4O5S/c1-14-19(12-15-11-16(22)5-6-20(15)23-14)21(27)24-7-9-25(10-8-24)32(30,31)18-4-2-3-17(13-18)26(28)29/h2-6,11-13H,7-10H2,1H3