bis[(2R)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] pyridine-2,6-dicarboxylate

Systemtic Name: bis[(2R)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl] pyridine-2,6-dicarboxylate Openeye Name: bis[(1R)-2-(isobutylamino)-1-methyl-2-oxo-ethyl] pyridine-2,6-dicarboxylate CAS Name: pyridine-2,6-dicarboxylic acid bis[(2R)-1-(2-methylpropylamino)-1-oxopropan-2-yl] ester IUPAC Name: bis[(2R)-1-(2-methylpropylamino)-1-oxopropan-2-yl] pyridine-2,6-dicarboxylate Traditional Name: pyridine-2,6-dicarboxylic acid bis[(1R)-2-(isobutylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H31N3O6 MolecularWeight: 421.48734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C1=NC(=CC=C1)C(=O)OC(C)C(=O)NCC(C)C

Isomeric SMILES

C[C@H](C(=O)NCC(C)C)OC(=O)C1=NC(=CC=C1)C(=O)O[C@H](C)C(=O)NCC(C)C

InChI

InChI=1S/C21H31N3O6/c1-12(2)10-22-18(25)14(5)29-20(27)16-8-7-9-17(24-16)21(28)30-15(6)19(26)23-11-13(3)4/h7-9,12-15H,10-11H2,1-6H3,(H,22,25)(H,23,26)/t14-,15-/m1/s1