2,6-dimethyl-1-(3-nitrophenyl)-5-propan-2-yloxycarbonyl-4H-pyridine-3-carboxylic acid

Systemtic Name: 2,6-dimethyl-1-(3-nitrophenyl)-5-propan-2-yloxycarbonyl-4H-pyridine-3-carboxylic acid Openeye Name: 5-isopropoxycarbonyl-2,6-dimethyl-1-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid CAS Name: 2,6-dimethyl-1-(3-nitrophenyl)-5-[oxo(propan-2-yloxy)methyl]-4H-pyridine-3-carboxylic acid IUPAC Name: 2,6-dimethyl-1-(3-nitrophenyl)-5-propan-2-yloxycarbonyl-4H-pyridine-3-carboxylic acid Traditional Name: 5-isopropoxycarbonyl-2,6-dimethyl-1-(3-nitrophenyl)-4H-pyridine-3-carboxylic acid Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(=C(N1C2=CC(=CC=C2)[N+](=O)[O-])C)C(=O)OC(C)C)C(=O)O

Isomeric SMILES

CC1=C(CC(=C(N1C2=CC(=CC=C2)[N+](=O)[O-])C)C(=O)OC(C)C)C(=O)O

InChI

InChI=1S/C18H20N2O6/c1-10(2)26-18(23)16-9-15(17(21)22)11(3)19(12(16)4)13-6-5-7-14(8-13)20(24)25/h5-8,10H,9H2,1-4H3,(H,21,22)