N-[4-[bis(fluoranyl)methoxy]phenyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]phenyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: N-[4-(difluoromethoxy)phenyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: N-[4-(difluoromethoxy)phenyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: N-[4-(difluoromethoxy)phenyl]-2-ethylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: N-[4-(difluoromethoxy)phenyl]-2-esyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C19H20F2N2O4S MolecularWeight: 410.434906

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC=C(C=C3)OC(F)F

Isomeric SMILES

CCS(=O)(=O)N1CC2=CC=CC=C2CC1C(=O)NC3=CC=C(C=C3)OC(F)F

InChI

InChI=1S/C19H20F2N2O4S/c1-2-28(25,26)23-12-14-6-4-3-5-13(14)11-17(23)18(24)22-15-7-9-16(10-8-15)27-19(20)21/h3-10,17,19H,2,11-12H2,1H3,(H,22,24)