methyl 5-(2-azanyloxycarbonyl-2-methyl-butanoyl)-2-methyl-4-(3-nitrophenyl)pyridine-3-carboxylate

Systemtic Name: methyl 5-(2-azanyloxycarbonyl-2-methyl-butanoyl)-2-methyl-4-(3-nitrophenyl)pyridine-3-carboxylate Openeye Name: methyl 5-(2-aminooxycarbonyl-2-methyl-butanoyl)-2-methyl-4-(3-nitrophenyl)pyridine-3-carboxylate CAS Name: 5-[2-[aminooxy(oxo)methyl]-2-methyl-1-oxobutyl]-2-methyl-4-(3-nitrophenyl)-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 5-(2-aminooxycarbonyl-2-methylbutanoyl)-2-methyl-4-(3-nitrophenyl)pyridine-3-carboxylate Traditional Name: 5-(2-aminooxycarbonyl-2-methyl-butanoyl)-2-methyl-4-(3-nitrophenyl)nicotinic acid methyl ester Formula: C20H21N3O7 MolecularWeight: 415.39664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C(=O)C1=CN=C(C(=C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)C(=O)ON

Isomeric SMILES

CCC(C)(C(=O)C1=CN=C(C(=C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)C(=O)ON

InChI

InChI=1S/C20H21N3O7/c1-5-20(3,19(26)30-21)17(24)14-10-22-11(2)15(18(25)29-4)16(14)12-7-6-8-13(9-12)23(27)28/h6-10H,5,21H2,1-4H3