2-(4-methoxy-3-oxidanyl-phenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione

Systemtic Name: 2-(4-methoxy-3-oxidanyl-phenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Openeye Name: 2-(3-hydroxy-4-methoxy-phenyl)-5-(3-nitrophenoxy)isoindoline-1,3-dione CAS Name: 2-(3-hydroxy-4-methoxyphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione IUPAC Name: 2-(3-hydroxy-4-methoxyphenyl)-5-(3-nitrophenoxy)isoindole-1,3-dione Traditional Name: 2-(3-hydroxy-4-methoxy-phenyl)-5-(3-nitrophenoxy)isoindoline-1,3-quinone Formula: C21H14N2O7 MolecularWeight: 406.34506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-])O

Isomeric SMILES

COC1=C(C=C(C=C1)N2C(=O)C3=C(C2=O)C=C(C=C3)OC4=CC=CC(=C4)[N+](=O)[O-])O

InChI

InChI=1S/C21H14N2O7/c1-29-19-8-5-12(10-18(19)24)22-20(25)16-7-6-15(11-17(16)21(22)26)30-14-4-2-3-13(9-14)23(27)28/h2-11,24H,1H3