[4-(3-nitrooxypropyl)phenyl]carbonyloxymethyl 2-acetyloxybenzoate

Systemtic Name: [4-(3-nitrooxypropyl)phenyl]carbonyloxymethyl 2-acetyloxybenzoate Openeye Name: [4-(3-nitrooxypropyl)benzoyl]oxymethyl 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [[4-(3-nitrooxypropyl)phenyl]-oxomethoxy]methyl ester IUPAC Name: [4-(3-nitrooxypropyl)benzoyl]oxymethyl 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [4-(3-nitrooxypropyl)benzoyl]oxymethyl ester Formula: C20H19NO9 MolecularWeight: 417.36616

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OCOC(=O)C2=CC=C(C=C2)CCCO[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCOC(=O)C2=CC=C(C=C2)CCCO[N+](=O)[O-]

InChI

InChI=1S/C20H19NO9/c1-14(22)30-18-7-3-2-6-17(18)20(24)28-13-27-19(23)16-10-8-15(9-11-16)5-4-12-29-21(25)26/h2-3,6-11H,4-5,12-13H2,1H3