2-[[4-(2-bromanylethanoyl)-1,6-dimethyl-2-oxidanylidene-pyridin-3-yl]methyl]isoindole-1,3-dione

Systemtic Name: 2-[[4-(2-bromanylethanoyl)-1,6-dimethyl-2-oxidanylidene-pyridin-3-yl]methyl]isoindole-1,3-dione Openeye Name: 2-[[4-(2-bromoacetyl)-1,6-dimethyl-2-oxo-3-pyridyl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-(2-bromo-1-oxoethyl)-1,6-dimethyl-2-oxo-3-pyridinyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-(2-bromoacetyl)-1,6-dimethyl-2-oxopyridin-3-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[4-(2-bromoacetyl)-2-keto-1,6-dimethyl-3-pyridyl]methyl]isoindoline-1,3-quinone Formula: C18H15BrN2O4 MolecularWeight: 403.2267

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=O)N1C)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)CBr

Isomeric SMILES

CC1=CC(=C(C(=O)N1C)CN2C(=O)C3=CC=CC=C3C2=O)C(=O)CBr

InChI

InChI=1S/C18H15BrN2O4/c1-10-7-13(15(22)8-19)14(16(23)20(10)2)9-21-17(24)11-5-3-4-6-12(11)18(21)25/h3-7H,8-9H2,1-2H3