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

Systemtic Name: 4-nitro-2-[2-oxidanylidene-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]isoindole-1,3-dione Openeye Name: 4-nitro-2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]isoindoline-1,3-dione CAS Name: 4-nitro-2-[2-oxo-2-(1,2,5-trimethyl-3-pyrrolyl)ethyl]isoindole-1,3-dione IUPAC Name: 4-nitro-2-[2-oxo-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]isoindole-1,3-dione Traditional Name: 2-[2-keto-2-(1,2,5-trimethylpyrrol-3-yl)ethyl]-4-nitro-isoindoline-1,3-quinone Formula: C17H15N3O5 MolecularWeight: 341.3181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C)C)C(=O)CN2C(=O)C3=C(C2=O)C(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N3O5/c1-9-7-12(10(2)18(9)3)14(21)8-19-16(22)11-5-4-6-13(20(24)25)15(11)17(19)23/h4-7H,8H2,1-3H3