[2-(3-nitrooxypropoxy)phenyl]carbonyloxymethyl 2-oxidanylbenzoate

Systemtic Name: [2-(3-nitrooxypropoxy)phenyl]carbonyloxymethyl 2-oxidanylbenzoate Openeye Name: [2-(3-nitrooxypropoxy)benzoyl]oxymethyl 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid [[2-(3-nitrooxypropoxy)phenyl]-oxomethoxy]methyl ester IUPAC Name: [2-(3-nitrooxypropoxy)benzoyl]oxymethyl 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid [2-(3-nitrooxypropoxy)benzoyl]oxymethyl ester Formula: C18H17NO9 MolecularWeight: 391.32888

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)OCOC(=O)C2=CC=CC=C2OCCCO[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)OCOC(=O)C2=CC=CC=C2OCCCO[N+](=O)[O-])O

InChI

InChI=1S/C18H17NO9/c20-15-8-3-1-6-13(15)17(21)26-12-27-18(22)14-7-2-4-9-16(14)25-10-5-11-28-19(23)24/h1-4,6-9,20H,5,10-12H2