(5-methyl-2-propan-2-yl-phenyl) 6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyridine-3-carboxylate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyridine-3-carboxylate Openeye Name: (2-isopropyl-5-methyl-phenyl) 6-[(tert-butoxycarbonylamino)methyl]pyridine-3-carboxylate CAS Name: 6-[[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-3-pyridinecarboxylic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 6-[[(2-methylpropan-2-yl)oxycarbonylamino]methyl]pyridine-3-carboxylate Traditional Name: 6-[(tert-butoxycarbonylamino)methyl]nicotinic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C22H28N2O4 MolecularWeight: 384.46872

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CN=C(C=C2)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OC(=O)C2=CN=C(C=C2)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C22H28N2O4/c1-14(2)18-10-7-15(3)11-19(18)27-20(25)16-8-9-17(23-12-16)13-24-21(26)28-22(4,5)6/h7-12,14H,13H2,1-6H3,(H,24,26)