N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]-3,5-bis(trifluoromethyl)benzamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]-3,5-bis(trifluoromethyl)benzamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-3,5-bis(trifluoromethyl)benzamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-3,5-bis(trifluoromethyl)benzamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-3,5-bis(trifluoromethyl)benzamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]-3,5-bis(trifluoromethyl)benzamide Formula: C29H25F6N3O2 MolecularWeight: 561.518119

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C29H25F6N3O2/c30-28(31,32)21-13-20(14-22(15-21)29(33,34)35)26(39)36-23-7-8-25(24(16-23)27(40)37-10-3-4-11-37)38-12-9-18-5-1-2-6-19(18)17-38/h1-2,5-8,13-16H,3-4,9-12,17H2,(H,36,39)