1-[7-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-2,2,2-tris(fluoranyl)ethanone

Systemtic Name: 1-[7-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-2,2,2-tris(fluoranyl)ethanone Openeye Name: 1-[7-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-2,2,2-trifluoro-ethanone CAS Name: 1-[7-[[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-1H-isoquinolin-2-yl]-2,2,2-trifluoroethanone IUPAC Name: 1-[7-[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]-2,2,2-trifluoroethanone Traditional Name: 2,2,2-trifluoro-1-[7-(4-o-phenetylpiperazino)sulfonyl-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C23H26F3N3O4S MolecularWeight: 497.53045

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCN(C4)C(=O)C(F)(F)F)C=C3

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCN(C4)C(=O)C(F)(F)F)C=C3

InChI

InChI=1S/C23H26F3N3O4S/c1-2-33-21-6-4-3-5-20(21)27-11-13-29(14-12-27)34(31,32)19-8-7-17-9-10-28(16-18(17)15-19)22(30)23(24,25)26/h3-8,15H,2,9-14,16H2,1H3