N-(5-iodanyl-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-methoxy-3-(trifluoromethyl)benzamide

Systemtic Name: N-(5-iodanyl-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-methoxy-3-(trifluoromethyl)benzamide Openeye Name: N-(5-iodo-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-methoxy-3-(trifluoromethyl)benzamide CAS Name: N-(5-iodo-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-methoxy-3-(trifluoromethyl)benzamide IUPAC Name: N-(5-iodo-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-methoxy-3-(trifluoromethyl)benzamide Traditional Name: N-(5-iodo-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-methoxy-3-(trifluoromethyl)benzamide Formula: C21H22F3IN2O2 MolecularWeight: 518.31126

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=CC(=C2CCN1C)I)NC(=O)C3=CC(=C(C=C3)OC)C(F)(F)F)C

Isomeric SMILES

CC1(C2=CC(=CC(=C2CCN1C)I)NC(=O)C3=CC(=C(C=C3)OC)C(F)(F)F)C

InChI

InChI=1S/C21H22F3IN2O2/c1-20(2)15-10-13(11-17(25)14(15)7-8-27(20)3)26-19(28)12-5-6-18(29-4)16(9-12)21(22,23)24/h5-6,9-11H,7-8H2,1-4H3,(H,26,28)