2-(2-methylpropanoyl)-4-nitro-indene-1,3-dione

Systemtic Name: 2-(2-methylpropanoyl)-4-nitro-indene-1,3-dione Openeye Name: 2-(2-methylpropanoyl)-4-nitro-indane-1,3-dione CAS Name: 2-(2-methyl-1-oxopropyl)-4-nitroindene-1,3-dione IUPAC Name: 2-(2-methylpropanoyl)-4-nitroindene-1,3-dione Traditional Name: 2-isobutyryl-4-nitro-indane-1,3-quinone Formula: C13H11NO5 MolecularWeight: 261.23014

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)C1C(=O)C2=C(C1=O)C(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11NO5/c1-6(2)11(15)10-12(16)7-4-3-5-8(14(18)19)9(7)13(10)17/h3-6,10H,1-2H3