5-(4-bromanylphenoxy)-2-(2-methyl-4-nitro-phenyl)isoindole-1,3-dione

Systemtic Name: 5-(4-bromanylphenoxy)-2-(2-methyl-4-nitro-phenyl)isoindole-1,3-dione Openeye Name: 5-(4-bromophenoxy)-2-(2-methyl-4-nitro-phenyl)isoindoline-1,3-dione CAS Name: 5-(4-bromophenoxy)-2-(2-methyl-4-nitrophenyl)isoindole-1,3-dione IUPAC Name: 5-(4-bromophenoxy)-2-(2-methyl-4-nitrophenyl)isoindole-1,3-dione Traditional Name: 5-(4-bromophenoxy)-2-(2-methyl-4-nitro-phenyl)isoindoline-1,3-quinone Formula: C21H13BrN2O5 MolecularWeight: 453.24232

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=C(C=C4)Br

InChI

InChI=1S/C21H13BrN2O5/c1-12-10-14(24(27)28)4-9-19(12)23-20(25)17-8-7-16(11-18(17)21(23)26)29-15-5-2-13(22)3-6-15/h2-11H,1H3