[3-(nitrooxymethyl)pyridin-2-yl]methyl 2-acetyloxybenzoate

Systemtic Name: [3-(nitrooxymethyl)pyridin-2-yl]methyl 2-acetyloxybenzoate Openeye Name: [3-(nitrooxymethyl)-2-pyridyl]methyl 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [3-(nitrooxymethyl)-2-pyridinyl]methyl ester IUPAC Name: [3-(nitrooxymethyl)pyridin-2-yl]methyl 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [3-(nitrooxymethyl)-2-pyridyl]methyl ester Formula: C16H14N2O7 MolecularWeight: 346.29156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OCC2=C(C=CC=N2)CO[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCC2=C(C=CC=N2)CO[N+](=O)[O-]

InChI

InChI=1S/C16H14N2O7/c1-11(19)25-15-7-3-2-6-13(15)16(20)23-10-14-12(5-4-8-17-14)9-24-18(21)22/h2-8H,9-10H2,1H3