[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methyl-5-nitro-phenyl)methanone

Systemtic Name: [4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methyl-5-nitro-phenyl)methanone Openeye Name: [4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methyl-5-nitro-phenyl)methanone CAS Name: [4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-(3-fluoro-4-methyl-5-nitrophenyl)methanone IUPAC Name: [4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methyl-5-nitrophenyl)methanone Traditional Name: [4-(2-chlorophenyl)sulfonylpiperazino]-(3-fluoro-4-methyl-5-nitro-phenyl)methanone Formula: C18H17ClFN3O5S MolecularWeight: 441.861083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1F)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H17ClFN3O5S/c1-12-15(20)10-13(11-16(12)23(25)26)18(24)21-6-8-22(9-7-21)29(27,28)17-5-3-2-4-14(17)19/h2-5,10-11H,6-9H2,1H3