3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-4-carboxamide

Systemtic Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-4-carboxamide Openeye Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-4-carboxamide CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-4-carboxamide IUPAC Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-4-carboxamide Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-1-keto-3,4-dihydro-2H-isoquinoline-4-carboxamide Formula: C22H18F6N2O2 MolecularWeight: 456.380939

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CNC(=O)C2C(NC(=O)C3=CC=CC=C23)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CC1CNC(=O)C2C(NC(=O)C3=CC=CC=C23)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C22H18F6N2O2/c23-21(24,25)13-7-12(8-14(9-13)22(26,27)28)18-17(20(32)29-10-11-5-6-11)15-3-1-2-4-16(15)19(31)30-18/h1-4,7-9,11,17-18H,5-6,10H2,(H,29,32)(H,30,31)