(4-nitrophenyl) 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carboxylate

Systemtic Name: (4-nitrophenyl) 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carboxylate Openeye Name: (4-nitrophenyl) 4-(tert-butoxycarbonylamino)-1-methyl-pyrrole-2-carboxylate CAS Name: 1-methyl-4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-pyrrolecarboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 1-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]pyrrole-2-carboxylate Traditional Name: 4-(tert-butoxycarbonylamino)-1-methyl-pyrrole-2-carboxylic acid (4-nitrophenyl) ester Formula: C17H19N3O6 MolecularWeight: 361.34926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CN(C(=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CN(C(=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H19N3O6/c1-17(2,3)26-16(22)18-11-9-14(19(4)10-11)15(21)25-13-7-5-12(6-8-13)20(23)24/h5-10H,1-4H3,(H,18,22)