8-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-fluoranyl-quinoline

Systemtic Name: 8-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-fluoranyl-quinoline Openeye Name: 8-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-fluoro-quinoline CAS Name: 8-[[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]methyl]-6-fluoroquinoline IUPAC Name: 8-[[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]methyl]-6-fluoroquinoline Traditional Name: 6-fluoro-8-[(4-p-phenetylsulfonylpiperazino)methyl]quinoline Formula: C22H24FN3O3S MolecularWeight: 429.507663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C4C(=CC(=C3)F)C=CC=N4

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC3=C4C(=CC(=C3)F)C=CC=N4

InChI

InChI=1S/C22H24FN3O3S/c1-2-29-20-5-7-21(8-6-20)30(27,28)26-12-10-25(11-13-26)16-18-15-19(23)14-17-4-3-9-24-22(17)18/h3-9,14-15H,2,10-13,16H2,1H3