3-[(1,2-dimethyl-4-nitro-3-oxidanylidene-1,2-dihydroinden-5-yl)oxy]-2-oxidanylidene-butanal

Systemtic Name: 3-[(1,2-dimethyl-4-nitro-3-oxidanylidene-1,2-dihydroinden-5-yl)oxy]-2-oxidanylidene-butanal Openeye Name: 3-(1,2-dimethyl-4-nitro-3-oxo-indan-5-yl)oxy-2-oxo-butanal CAS Name: 3-[(1,2-dimethyl-4-nitro-3-oxo-1,2-dihydroinden-5-yl)oxy]-2-oxobutanal IUPAC Name: 3-[(1,2-dimethyl-4-nitro-3-oxo-1,2-dihydroinden-5-yl)oxy]-2-oxobutanal Traditional Name: 2-keto-3-(3-keto-1,2-dimethyl-4-nitro-indan-5-yl)oxy-butyraldehyde Formula: C15H15NO6 MolecularWeight: 305.2827

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(=O)C2=C1C=CC(=C2[N+](=O)[O-])OC(C)C(=O)C=O)C

Isomeric SMILES

CC1C(C(=O)C2=C1C=CC(=C2[N+](=O)[O-])OC(C)C(=O)C=O)C

InChI

InChI=1S/C15H15NO6/c1-7-8(2)15(19)13-10(7)4-5-12(14(13)16(20)21)22-9(3)11(18)6-17/h4-9H,1-3H3