2-[(6-bromanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(6-bromanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(6-bromo-4-oxo-3,1-benzoxazin-2-yl)methyl]isoindoline-1,3-dione CAS Name: 2-[(6-bromo-4-oxo-3,1-benzoxazin-2-yl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(6-bromo-4-oxo-3,1-benzoxazin-2-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(6-bromo-4-keto-3,1-benzoxazin-2-yl)methyl]isoindoline-1,3-quinone Formula: C17H9BrN2O4 MolecularWeight: 385.16836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=NC4=C(C=C(C=C4)Br)C(=O)O3

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CC3=NC4=C(C=C(C=C4)Br)C(=O)O3

InChI

InChI=1S/C17H9BrN2O4/c18-9-5-6-13-12(7-9)17(23)24-14(19-13)8-20-15(21)10-3-1-2-4-11(10)16(20)22/h1-7H,8H2