5-nitro-2-[2-oxidanylidene-2-(4-propylphenyl)ethyl]isoindole-1,3-dione

Systemtic Name: 5-nitro-2-[2-oxidanylidene-2-(4-propylphenyl)ethyl]isoindole-1,3-dione Openeye Name: 5-nitro-2-[2-oxo-2-(4-propylphenyl)ethyl]isoindoline-1,3-dione CAS Name: 5-nitro-2-[2-oxo-2-(4-propylphenyl)ethyl]isoindole-1,3-dione IUPAC Name: 5-nitro-2-[2-oxo-2-(4-propylphenyl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-(4-propylphenyl)ethyl]-5-nitro-isoindoline-1,3-quinone Formula: C19H16N2O5 MolecularWeight: 352.34074

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)CN2C(=O)C3=C(C2=O)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H16N2O5/c1-2-3-12-4-6-13(7-5-12)17(22)11-20-18(23)15-9-8-14(21(25)26)10-16(15)19(20)24/h4-10H,2-3,11H2,1H3