1,3-dinitrooxypropan-2-yl 2-acetyloxybenzoate

Systemtic Name: 1,3-dinitrooxypropan-2-yl 2-acetyloxybenzoate Openeye Name: [2-nitrooxy-1-(nitrooxymethyl)ethyl] 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid 1,3-dinitrooxypropan-2-yl ester IUPAC Name: 1,3-dinitrooxypropan-2-yl 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [2-nitrooxy-1-(nitrooxymethyl)ethyl] ester Formula: C12H12N2O10 MolecularWeight: 344.23108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12N2O10/c1-8(15)23-11-5-3-2-4-10(11)12(16)24-9(6-21-13(17)18)7-22-14(19)20/h2-5,9H,6-7H2,1H3