tert-butyl [2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-nitrooxyethylamino)-3-oxidanylidene-propyl]sulfanylmethanoate

Systemtic Name: tert-butyl [2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-nitrooxyethylamino)-3-oxidanylidene-propyl]sulfanylmethanoate Openeye Name: tert-butyl [2-(tert-butoxycarbonylamino)-3-(2-nitrooxyethylamino)-3-oxo-propyl]sulfanylformate CAS Name: [[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-(2-nitrooxyethylamino)-3-oxopropyl]thio]formic acid tert-butyl ester IUPAC Name: tert-butyl [2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-nitrooxyethylamino)-3-oxopropyl]sulfanylformate Traditional Name: [[2-(tert-butoxycarbonylamino)-3-keto-3-(2-nitrooxyethylamino)propyl]thio]formic acid tert-butyl ester Formula: C15H27N3O8S MolecularWeight: 409.45518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CSC(=O)OC(C)(C)C)C(=O)NCCO[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CSC(=O)OC(C)(C)C)C(=O)NCCO[N+](=O)[O-]

InChI

InChI=1S/C15H27N3O8S/c1-14(2,3)25-12(20)17-10(9-27-13(21)26-15(4,5)6)11(19)16-7-8-24-18(22)23/h10H,7-9H2,1-6H3,(H,16,19)(H,17,20)