[2-[2-(2-nitrooxyethyldisulfanyl)ethoxy]-2-oxidanylidene-ethyl] 2-acetyloxybenzoate

Systemtic Name: [2-[2-(2-nitrooxyethyldisulfanyl)ethoxy]-2-oxidanylidene-ethyl] 2-acetyloxybenzoate Openeye Name: [2-[2-(2-nitrooxyethyldisulfanyl)ethoxy]-2-oxo-ethyl] 2-acetoxybenzoate CAS Name: 2-acetyloxybenzoic acid [2-[2-(2-nitrooxyethyldisulfanyl)ethoxy]-2-oxoethyl] ester IUPAC Name: [2-[2-(2-nitrooxyethyldisulfanyl)ethoxy]-2-oxoethyl] 2-acetyloxybenzoate Traditional Name: 2-acetoxybenzoic acid [2-keto-2-[2-(2-nitrooxyethyldisulfanyl)ethoxy]ethyl] ester Formula: C15H17NO9S2 MolecularWeight: 419.42678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC=C1C(=O)OCC(=O)OCCSSCCO[N+](=O)[O-]

Isomeric SMILES

CC(=O)OC1=CC=CC=C1C(=O)OCC(=O)OCCSSCCO[N+](=O)[O-]

InChI

InChI=1S/C15H17NO9S2/c1-11(17)25-13-5-3-2-4-12(13)15(19)23-10-14(18)22-6-8-26-27-9-7-24-16(20)21/h2-5H,6-10H2,1H3