[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone

Systemtic Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoranyl-4-methoxy-phenyl)methanone Openeye Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methoxy-phenyl)methanone CAS Name: [4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-(3-fluoro-4-methoxyphenyl)methanone IUPAC Name: [4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-(3-fluoro-4-methoxyphenyl)methanone Traditional Name: (3-fluoro-4-methoxy-phenyl)-(4-p-phenetylsulfonylpiperazino)methanone Formula: C20H23FN2O5S MolecularWeight: 422.470423

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C20H23FN2O5S/c1-3-28-16-5-7-17(8-6-16)29(25,26)23-12-10-22(11-13-23)20(24)15-4-9-19(27-2)18(21)14-15/h4-9,14H,3,10-13H2,1-2H3