(2,2-dimethyl-3-nitrooxy-propyl) 2-acetyloxy-5-methyl-benzoate

Systemtic Name: (2,2-dimethyl-3-nitrooxy-propyl) 2-acetyloxy-5-methyl-benzoate Openeye Name: (2,2-dimethyl-3-nitrooxy-propyl) 2-acetoxy-5-methyl-benzoate CAS Name: 2-acetyloxy-5-methylbenzoic acid (2,2-dimethyl-3-nitrooxypropyl) ester IUPAC Name: (2,2-dimethyl-3-nitrooxypropyl) 2-acetyloxy-5-methylbenzoate Traditional Name: 2-acetoxy-5-methyl-benzoic acid (2,2-dimethyl-3-nitrooxy-propyl) ester Formula: C15H19NO7 MolecularWeight: 325.31386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C)C(=O)OCC(C)(C)CO[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C)C(=O)OCC(C)(C)CO[N+](=O)[O-]

InChI

InChI=1S/C15H19NO7/c1-10-5-6-13(23-11(2)17)12(7-10)14(18)21-8-15(3,4)9-22-16(19)20/h5-7H,8-9H2,1-4H3