2-[[2-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-6-yl)sulfonyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[2-[(5-bromanyl-1-ethanoyl-2,3-dihydroindol-6-yl)sulfonyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[2-(1-acetyl-5-bromo-indolin-6-yl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[2-[(1-acetyl-5-bromo-2,3-dihydroindol-6-yl)sulfonyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[2-[(1-acetyl-5-bromo-2,3-dihydroindol-6-yl)sulfonyl]-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[2-(1-acetyl-5-bromo-indolin-6-yl)sulfonyl-3,4-dihydro-1H-isoquinolin-1-yl]methyl]isoindoline-1,3-quinone Formula: C28H24BrN3O5S MolecularWeight: 594.47626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)N3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O)Br

Isomeric SMILES

CC(=O)N1CCC2=CC(=C(C=C21)S(=O)(=O)N3CCC4=CC=CC=C4C3CN5C(=O)C6=CC=CC=C6C5=O)Br

InChI

InChI=1S/C28H24BrN3O5S/c1-17(33)30-12-10-19-14-23(29)26(15-24(19)30)38(36,37)32-13-11-18-6-2-3-7-20(18)25(32)16-31-27(34)21-8-4-5-9-22(21)28(31)35/h2-9,14-15,25H,10-13,16H2,1H3