1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-(3-fluoranyl-4-methoxy-phenyl)propan-1-one

Systemtic Name: 1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-(3-fluoranyl-4-methoxy-phenyl)propan-1-one Openeye Name: 1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-(3-fluoro-4-methoxy-phenyl)propan-1-one CAS Name: 1-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-3-(3-fluoro-4-methoxyphenyl)-1-propanone IUPAC Name: 1-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-3-(3-fluoro-4-methoxyphenyl)propan-1-one Traditional Name: 1-[4-(2-chlorophenyl)sulfonylpiperazino]-3-(3-fluoro-4-methoxy-phenyl)propan-1-one Formula: C20H22ClFN2O4S MolecularWeight: 440.916083

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)F

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3Cl)F

InChI

InChI=1S/C20H22ClFN2O4S/c1-28-18-8-6-15(14-17(18)22)7-9-20(25)23-10-12-24(13-11-23)29(26,27)19-5-3-2-4-16(19)21/h2-6,8,14H,7,9-13H2,1H3