2-cyano-3-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1-propan-2-yl-2H-pyridine-5-carboxylic acid

Systemtic Name: 2-cyano-3-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1-propan-2-yl-2H-pyridine-5-carboxylic acid Openeye Name: 2-cyano-1-isopropyl-3-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-2H-pyridine-5-carboxylic acid CAS Name: 2-cyano-3-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1-propan-2-yl-2H-pyridine-5-carboxylic acid IUPAC Name: 2-cyano-3-methoxycarbonyl-6-methyl-4-(3-nitrophenyl)-1-propan-2-yl-2H-pyridine-5-carboxylic acid Traditional Name: 3-carbomethoxy-2-cyano-1-isopropyl-6-methyl-4-(3-nitrophenyl)-2H-pyridine-5-carboxylic acid Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(N1C(C)C)C#N)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=C(C(=C(C(N1C(C)C)C#N)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C19H19N3O6/c1-10(2)21-11(3)15(18(23)24)16(17(14(21)9-20)19(25)28-4)12-6-5-7-13(8-12)22(26)27/h5-8,10,14H,1-4H3,(H,23,24)