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

Systemtic Name: [4-(3-nitrooxypropylsulfonyl)phenyl]carbonyloxymethyl 2-acetyloxybenzoate Openeye Name: [4-(3-nitrooxypropylsulfonyl)benzoyl]oxymethyl 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [[4-(3-nitrooxypropylsulfonyl)phenyl]-oxomethoxy]methyl ester IUPAC Name: [4-(3-nitrooxypropylsulfonyl)benzoyl]oxymethyl 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [4-(3-nitrooxypropylsulfonyl)benzoyl]oxymethyl ester Formula: C20H19NO11S MolecularWeight: 481.42996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19NO11S/c1-14(22)32-18-6-3-2-5-17(18)20(24)30-13-29-19(23)15-7-9-16(10-8-15)33(27,28)12-4-11-31-21(25)26/h2-3,5-10H,4,11-13H2,1H3