5-(6-bromanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)-2-(2-ethoxyphenyl)isoindole-1,3-dione

Systemtic Name: 5-(6-bromanyl-4-oxidanylidene-3,1-benzoxazin-2-yl)-2-(2-ethoxyphenyl)isoindole-1,3-dione Openeye Name: 5-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-ethoxyphenyl)isoindoline-1,3-dione CAS Name: 5-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-ethoxyphenyl)isoindole-1,3-dione IUPAC Name: 5-(6-bromo-4-oxo-3,1-benzoxazin-2-yl)-2-(2-ethoxyphenyl)isoindole-1,3-dione Traditional Name: 5-(6-bromo-4-keto-3,1-benzoxazin-2-yl)-2-o-phenetyl-isoindoline-1,3-quinone Formula: C24H15BrN2O5 MolecularWeight: 491.2903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(C=C(C=C5)Br)C(=O)O4

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)C4=NC5=C(C=C(C=C5)Br)C(=O)O4

InChI

InChI=1S/C24H15BrN2O5/c1-2-31-20-6-4-3-5-19(20)27-22(28)15-9-7-13(11-16(15)23(27)29)21-26-18-10-8-14(25)12-17(18)24(30)32-21/h3-12H,2H2,1H3