O1-(cyclohexa-1,3-dien-1-ylmethyl) O5-(4-nitrophenyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate

Systemtic Name: O1-(cyclohexa-1,3-dien-1-ylmethyl) O5-(4-nitrophenyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate Openeye Name: O1-(cyclohexa-1,3-dien-1-ylmethyl) O5-(4-nitrophenyl) 2-(tert-butoxycarbonylamino)pentanedioate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanedioic acid O1-(1-cyclohexa-1,3-dienylmethyl) ester O5-(4-nitrophenyl) ester IUPAC Name: 1-O-(cyclohexa-1,3-dien-1-ylmethyl) 5-O-(4-nitrophenyl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanedioate Traditional Name: 2-(tert-butoxycarbonylamino)glutaric acid O1-(cyclohexa-1,3-dien-1-ylmethyl) ester O5-(4-nitrophenyl) ester Formula: C23H28N2O8 MolecularWeight: 460.47702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC=CCC2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CCC(=O)OC1=CC=C(C=C1)[N+](=O)[O-])C(=O)OCC2=CC=CCC2

InChI

InChI=1S/C23H28N2O8/c1-23(2,3)33-22(28)24-19(21(27)31-15-16-7-5-4-6-8-16)13-14-20(26)32-18-11-9-17(10-12-18)25(29)30/h4-5,7,9-12,19H,6,8,13-15H2,1-3H3,(H,24,28)