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

Systemtic Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-2,3-dimethyl-1-oxidanylidene-4H-isoquinoline-4-carboxamide Openeye Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-2,3-dimethyl-1-oxo-4H-isoquinoline-4-carboxamide CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-2,3-dimethyl-1-oxo-4H-isoquinoline-4-carboxamide IUPAC Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-2,3-dimethyl-1-oxo-4H-isoquinoline-4-carboxamide Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]-N-(cyclopropylmethyl)-1-keto-2,3-dimethyl-4H-isoquinoline-4-carboxamide Formula: C24H22F6N2O2 MolecularWeight: 484.434099

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=CC=CC=C2C(=O)N1C)C(=O)NCC3CC3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CC1(C(C2=CC=CC=C2C(=O)N1C)C(=O)NCC3CC3)C4=CC(=CC(=C4)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C24H22F6N2O2/c1-22(14-9-15(23(25,26)27)11-16(10-14)24(28,29)30)19(20(33)31-12-13-7-8-13)17-5-3-4-6-18(17)21(34)32(22)2/h3-6,9-11,13,19H,7-8,12H2,1-2H3,(H,31,33)