[2-[[4-(nitrooxymethyl)phenyl]disulfanyl]pyridin-3-yl]methyl nitrate

Systemtic Name: [2-[[4-(nitrooxymethyl)phenyl]disulfanyl]pyridin-3-yl]methyl nitrate Openeye Name: [2-[[4-(nitrooxymethyl)phenyl]disulfanyl]-3-pyridyl]methyl nitrate CAS Name: nitric acid [2-[[4-(nitrooxymethyl)phenyl]disulfanyl]-3-pyridinyl]methyl ester IUPAC Name: [2-[[4-(nitrooxymethyl)phenyl]disulfanyl]pyridin-3-yl]methyl nitrate Traditional Name: nitric acid [2-[[4-(nitrooxymethyl)phenyl]disulfanyl]-3-pyridyl]methyl ester Formula: C13H11N3O6S2 MolecularWeight: 369.37294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)SSC2=CC=C(C=C2)CO[N+](=O)[O-])CO[N+](=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)SSC2=CC=C(C=C2)CO[N+](=O)[O-])CO[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O6S2/c17-15(18)21-8-10-3-5-12(6-4-10)23-24-13-11(2-1-7-14-13)9-22-16(19)20/h1-7H,8-9H2