[4-[2-(diphenylmethyl)sulfinylethanoylamino]-1-nitrooxy-4-oxidanylidene-butan-2-yl] nitrate

Systemtic Name: [4-[2-(diphenylmethyl)sulfinylethanoylamino]-1-nitrooxy-4-oxidanylidene-butan-2-yl] nitrate Openeye Name: [3-[(2-benzhydrylsulfinylacetyl)amino]-1-(nitrooxymethyl)-3-oxo-propyl] nitrate CAS Name: nitric acid [4-[[2-(diphenylmethyl)sulfinyl-1-oxoethyl]amino]-1-nitrooxy-4-oxobutan-2-yl] ester IUPAC Name: [4-[(2-benzhydrylsulfinylacetyl)amino]-1-nitrooxy-4-oxobutan-2-yl] nitrate Traditional Name: nitric acid [4-[(2-benzhydrylsulfinylacetyl)amino]-4-keto-2-nitrooxy-butyl] ester Formula: C19H19N3O9S MolecularWeight: 465.43386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3O9S/c23-17(11-16(31-22(27)28)12-30-21(25)26)20-18(24)13-32(29)19(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h1-10,16,19H,11-13H2,(H,20,23,24)