(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonyl-3-piperidyl]methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonyl-3-piperidinyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonylpiperidin-3-yl]methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[1-(4-fluorophenyl)sulfonyl-3-piperidyl]methanone Formula: C23H27FN2O5S MolecularWeight: 462.534283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C23H27FN2O5S/c1-30-21-12-16-9-11-25(14-18(16)13-22(21)31-2)23(27)17-4-3-10-26(15-17)32(28,29)20-7-5-19(24)6-8-20/h5-8,12-13,17H,3-4,9-11,14-15H2,1-2H3