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

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfonyl]phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Openeye Name: N-[4-(difluoromethylsulfonyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide CAS Name: N-[4-(difluoromethylsulfonyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide IUPAC Name: N-[4-(difluoromethylsulfonyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Traditional Name: N-[4-(difluoromethylsulfonyl)phenyl]-3,4-dihydro-1H-isoquinoline-2-carboxamide Formula: C17H16F2N2O3S MolecularWeight: 366.382346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C(F)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)NC3=CC=C(C=C3)S(=O)(=O)C(F)F

InChI

InChI=1S/C17H16F2N2O3S/c18-16(19)25(23,24)15-7-5-14(6-8-15)20-17(22)21-10-9-12-3-1-2-4-13(12)11-21/h1-8,16H,9-11H2,(H,20,22)