2-bromanyl-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide

Systemtic Name: 2-bromanyl-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Openeye Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide CAS Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide IUPAC Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Traditional Name: 2-bromo-N-[2-(4-fluorophenyl)sulfonyl-3,4-dihydro-1H-isoquinolin-7-yl]benzamide Formula: C22H18BrFN2O3S MolecularWeight: 489.357323

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=CC=C3Br)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)C3=CC=CC=C3Br)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H18BrFN2O3S/c23-21-4-2-1-3-20(21)22(27)25-18-8-5-15-11-12-26(14-16(15)13-18)30(28,29)19-9-6-17(24)7-10-19/h1-10,13H,11-12,14H2,(H,25,27)