2-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-6-pyridin-2-yl-pyridine-3-carboxylic acid

Systemtic Name: 2-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-6-pyridin-2-yl-pyridine-3-carboxylic acid Openeye Name: 5-tert-butoxycarbonyl-2-methyl-4-phenyl-6-(2-pyridyl)pyridine-3-carboxylic acid CAS Name: 2-methyl-5-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenyl-6-(2-pyridinyl)-3-pyridinecarboxylic acid IUPAC Name: 2-methyl-5-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-6-pyridin-2-ylpyridine-3-carboxylic acid Traditional Name: 5-tert-butoxycarbonyl-2-methyl-4-phenyl-6-(2-pyridyl)nicotinic acid Formula: C23H22N2O4 MolecularWeight: 390.43178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=N1)C2=CC=CC=N2)C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C(=N1)C2=CC=CC=N2)C(=O)OC(C)(C)C)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H22N2O4/c1-14-17(21(26)27)18(15-10-6-5-7-11-15)19(22(28)29-23(2,3)4)20(25-14)16-12-8-9-13-24-16/h5-13H,1-4H3,(H,26,27)