(3-chloranyl-4,5-dimethoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-4,5-dimethoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-chloro-4,5-dimethoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (3-chloro-4,5-dimethoxyphenyl)-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-chloro-4,5-dimethoxyphenyl)-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-chloro-4,5-dimethoxy-phenyl)-[4-(4-fluorophenyl)sulfonylpiperazino]methanone Formula: C19H20ClFN2O5S MolecularWeight: 442.888903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)F)Cl)OC

InChI

InChI=1S/C19H20ClFN2O5S/c1-27-17-12-13(11-16(20)18(17)28-2)19(24)22-7-9-23(10-8-22)29(25,26)15-5-3-14(21)4-6-15/h3-6,11-12H,7-10H2,1-2H3