ethyl 2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-nitrophenyl)pyridine-3-carboxylate

Systemtic Name: ethyl 2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-nitrophenyl)pyridine-3-carboxylate Openeye Name: ethyl 6-(tert-butoxycarbonylamino)-2-methyl-4-(3-nitrophenyl)pyridine-3-carboxylate CAS Name: 2-methyl-6-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(3-nitrophenyl)-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-6-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(3-nitrophenyl)pyridine-3-carboxylate Traditional Name: 6-(tert-butoxycarbonylamino)-2-methyl-4-(3-nitrophenyl)nicotinic acid ethyl ester Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O6/c1-6-28-18(24)17-12(2)21-16(22-19(25)29-20(3,4)5)11-15(17)13-8-7-9-14(10-13)23(26)27/h7-11H,6H2,1-5H3,(H,21,22,25)