3-nitrooxypropyl 2-acetyloxybenzoate

Systemtic Name: 3-nitrooxypropyl 2-acetyloxybenzoate Openeye Name: 3-nitrooxypropyl 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid 3-nitrooxypropyl ester IUPAC Name: 3-nitrooxypropyl 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid 3-nitrooxypropyl ester Formula: C12H13NO7 MolecularWeight: 283.23412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OCCCO[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCCCO[N+](=O)[O-]

InChI

InChI=1S/C12H13NO7/c1-9(14)20-11-6-3-2-5-10(11)12(15)18-7-4-8-19-13(16)17/h2-3,5-6H,4,7-8H2,1H3