[1-[(4-methyl-2-oxidanylidene-chromen-7-yl)disulfanyl]-3-nitrooxy-propan-2-yl] nitrate

Systemtic Name: [1-[(4-methyl-2-oxidanylidene-chromen-7-yl)disulfanyl]-3-nitrooxy-propan-2-yl] nitrate Openeye Name: [1-[[(4-methyl-2-oxo-chromen-7-yl)disulfanyl]methyl]-2-nitrooxy-ethyl] nitrate CAS Name: nitric acid [1-[(4-methyl-2-oxo-1-benzopyran-7-yl)disulfanyl]-3-nitrooxypropan-2-yl] ester IUPAC Name: [1-[(4-methyl-2-oxochromen-7-yl)disulfanyl]-3-nitrooxypropan-2-yl] nitrate Traditional Name: nitric acid [1-[[(2-keto-4-methyl-chromen-7-yl)disulfanyl]methyl]-2-nitrooxy-ethyl] ester Formula: C13H12N2O8S2 MolecularWeight: 388.37298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)SSCC(CO[N+](=O)[O-])O[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)SSCC(CO[N+](=O)[O-])O[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O8S2/c1-8-4-13(16)22-12-5-10(2-3-11(8)12)25-24-7-9(23-15(19)20)6-21-14(17)18/h2-5,9H,6-7H2,1H3