[3-(nitrooxymethyl)phenyl]methyl 2-oxidanylidenepropanoate

Systemtic Name: [3-(nitrooxymethyl)phenyl]methyl 2-oxidanylidenepropanoate Openeye Name: [3-(nitrooxymethyl)phenyl]methyl 2-oxopropanoate CAS Name: 2-oxopropanoic acid [3-(nitrooxymethyl)phenyl]methyl ester IUPAC Name: [3-(nitrooxymethyl)phenyl]methyl 2-oxopropanoate Traditional Name: 2-ketopropionic acid [3-(nitrooxymethyl)benzyl] ester Formula: C11H11NO6 MolecularWeight: 253.20814

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=O)OCC1=CC(=CC=C1)CO[N+](=O)[O-]

Isomeric SMILES

CC(=O)C(=O)OCC1=CC(=CC=C1)CO[N+](=O)[O-]

InChI

InChI=1S/C11H11NO6/c1-8(13)11(14)17-6-9-3-2-4-10(5-9)7-18-12(15)16/h2-5H,6-7H2,1H3