2-[(5-ethanoyl-2-methoxy-phenyl)methyl]-4-nitro-isoindole-1,3-dione

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methyl]-4-nitro-isoindole-1,3-dione Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methyl]-4-nitro-isoindoline-1,3-dione CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methyl]-4-nitroisoindole-1,3-dione IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methyl]-4-nitroisoindole-1,3-dione Traditional Name: 2-(5-acetyl-2-methoxy-benzyl)-4-nitro-isoindoline-1,3-quinone Formula: C18H14N2O6 MolecularWeight: 354.31356

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H14N2O6/c1-10(21)11-6-7-15(26-2)12(8-11)9-19-17(22)13-4-3-5-14(20(24)25)16(13)18(19)23/h3-8H,9H2,1-2H3