5-bromanyl-2-[5-(4-nitrophenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid

Systemtic Name: 5-bromanyl-2-[5-(4-nitrophenoxy)-1,3-bis(oxidanylidene)isoindol-2-yl]benzoic acid Openeye Name: 5-bromo-2-[5-(4-nitrophenoxy)-1,3-dioxo-isoindolin-2-yl]benzoic acid CAS Name: 5-bromo-2-[5-(4-nitrophenoxy)-1,3-dioxo-2-isoindolyl]benzoic acid IUPAC Name: 5-bromo-2-[5-(4-nitrophenoxy)-1,3-dioxoisoindol-2-yl]benzoic acid Traditional Name: 5-bromo-2-[1,3-diketo-5-(4-nitrophenoxy)isoindolin-2-yl]benzoic acid Formula: C21H11BrN2O7 MolecularWeight: 483.22524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1[N+](=O)[O-])OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=C(C=C4)Br)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1[N+](=O)[O-])OC2=CC3=C(C=C2)C(=O)N(C3=O)C4=C(C=C(C=C4)Br)C(=O)O

InChI

InChI=1S/C21H11BrN2O7/c22-11-1-8-18(17(9-11)21(27)28)23-19(25)15-7-6-14(10-16(15)20(23)26)31-13-4-2-12(3-5-13)24(29)30/h1-10H,(H,27,28)