ethyl 5-azanyl-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)pyrrole-3-carboxylate

Systemtic Name: ethyl 5-azanyl-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)pyrrole-3-carboxylate Openeye Name: ethyl 5-amino-1-(tert-butoxycarbonylamino)-2-methyl-4-(4-nitrophenyl)pyrrole-3-carboxylate CAS Name: 5-amino-2-methyl-1-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(4-nitrophenyl)-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-2-methyl-1-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)pyrrole-3-carboxylate Traditional Name: 5-amino-1-(tert-butoxycarbonylamino)-2-methyl-4-(4-nitrophenyl)pyrrole-3-carboxylic acid ethyl ester Formula: C19H24N4O6 MolecularWeight: 404.41706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])N)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1C2=CC=C(C=C2)[N+](=O)[O-])N)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C19H24N4O6/c1-6-28-17(24)14-11(2)22(21-18(25)29-19(3,4)5)16(20)15(14)12-7-9-13(10-8-12)23(26)27/h7-10H,6,20H2,1-5H3,(H,21,25)