2-[[(2S)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidin-2-yl]carbonylamino]propyl nitrate

Systemtic Name: 2-[[(2S)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidin-2-yl]carbonylamino]propyl nitrate Openeye Name: 2-[[(2S)-1-(2-methyl-3-sulfanyl-propanoyl)pyrrolidine-2-carbonyl]amino]propyl nitrate CAS Name: nitric acid 2-[[[(2S)-1-(3-mercapto-2-methyl-1-oxopropyl)-2-pyrrolidinyl]-oxomethyl]amino]propyl ester IUPAC Name: 2-[[(2S)-1-(2-methyl-3-sulfanylpropanoyl)pyrrolidine-2-carbonyl]amino]propyl nitrate Traditional Name: nitric acid 2-[[(2S)-1-(3-mercapto-2-methyl-propanoyl)prolyl]amino]propyl ester Formula: C12H21N3O5S MolecularWeight: 319.37724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CO[N+](=O)[O-])NC(=O)C1CCCN1C(=O)C(C)CS

Isomeric SMILES

CC(CO[N+](=O)[O-])NC(=O)[C@@H]1CCCN1C(=O)C(C)CS

InChI

InChI=1S/C12H21N3O5S/c1-8(7-21)12(17)14-5-3-4-10(14)11(16)13-9(2)6-20-15(18)19/h8-10,21H,3-7H2,1-2H3,(H,13,16)/t8?,9?,10-/m0/s1