O1-tert-butyl O7-ethyl (E,6S)-2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]hept-2-enedioate

Systemtic Name: O1-tert-butyl O7-ethyl (E,6S)-2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]hept-2-enedioate Openeye Name: O1-tert-butyl O7-ethyl (E,6S)-6-(tert-butoxycarbonylamino)-2-methyl-hept-2-enedioate CAS Name: (E,6S)-2-methyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-heptenedioic acid O1-tert-butyl ester O7-ethyl ester IUPAC Name: 1-O-tert-butyl 7-O-ethyl (E,6S)-2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]hept-2-enedioate Traditional Name: (E,6S)-6-(tert-butoxycarbonylamino)-2-methyl-hept-2-enedioic acid O1-tert-butyl ester O7-ethyl ester Formula: C19H33NO6 MolecularWeight: 371.46842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCC=C(C)C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC(=O)[C@H](CC/C=C(\C)/C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C19H33NO6/c1-9-24-16(22)14(20-17(23)26-19(6,7)8)12-10-11-13(2)15(21)25-18(3,4)5/h11,14H,9-10,12H2,1-8H3,(H,20,23)/b13-11+/t14-/m0/s1