[2-[2-(2-nitrooxyethyldisulfanyl)ethylcarbamoyl]phenyl] ethanoate

Systemtic Name: [2-[2-(2-nitrooxyethyldisulfanyl)ethylcarbamoyl]phenyl] ethanoate Openeye Name: [2-[2-(2-nitrooxyethyldisulfanyl)ethylcarbamoyl]phenyl] acetate CAS Name: acetic acid [2-[[2-(2-nitrooxyethyldisulfanyl)ethylamino]-oxomethyl]phenyl] ester IUPAC Name: [2-[2-(2-nitrooxyethyldisulfanyl)ethylcarbamoyl]phenyl] acetate Traditional Name: acetic acid [2-[2-(2-nitrooxyethyldisulfanyl)ethylcarbamoyl]phenyl] ester Formula: C13H16N2O6S2 MolecularWeight: 360.40594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16N2O6S2/c1-10(16)21-12-5-3-2-4-11(12)13(17)14-6-8-22-23-9-7-20-15(18)19/h2-5H,6-9H2,1H3,(H,14,17)