2-(2-ethoxyphenyl)-5-nitro-isoindole-1,3-dione

Systemtic Name: 2-(2-ethoxyphenyl)-5-nitro-isoindole-1,3-dione Openeye Name: 2-(2-ethoxyphenyl)-5-nitro-isoindoline-1,3-dione CAS Name: 2-(2-ethoxyphenyl)-5-nitroisoindole-1,3-dione IUPAC Name: 2-(2-ethoxyphenyl)-5-nitroisoindole-1,3-dione Traditional Name: 5-nitro-2-o-phenetyl-isoindoline-1,3-quinone Formula: C16H12N2O5 MolecularWeight: 312.27688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=CC=C1N2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5/c1-2-23-14-6-4-3-5-13(14)17-15(19)11-8-7-10(18(21)22)9-12(11)16(17)20/h3-9H,2H2,1H3