2-[(3-methoxy-4-nitro-phenyl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(3-methoxy-4-nitro-phenyl)methyl]isoindole-1,3-dione Openeye Name: 2-[(3-methoxy-4-nitro-phenyl)methyl]isoindoline-1,3-dione CAS Name: 2-[(3-methoxy-4-nitrophenyl)methyl]isoindole-1,3-dione IUPAC Name: 2-[(3-methoxy-4-nitrophenyl)methyl]isoindole-1,3-dione Traditional Name: 2-(3-methoxy-4-nitro-benzyl)isoindoline-1,3-quinone Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)CN2C(=O)C3=CC=CC=C3C2=O)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5/c1-23-14-8-10(6-7-13(14)18(21)22)9-17-15(19)11-4-2-3-5-12(11)16(17)20/h2-8H,9H2,1H3