[(2S)-1-[di(propan-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2,6-dimethylquinoline-4-carboxylate

Systemtic Name: [(2S)-1-[di(propan-2-yl)amino]-1-oxidanylidene-propan-2-yl] 2,6-dimethylquinoline-4-carboxylate Openeye Name: [(1S)-2-(diisopropylamino)-1-methyl-2-oxo-ethyl] 2,6-dimethylquinoline-4-carboxylate CAS Name: 2,6-dimethyl-4-quinolinecarboxylic acid [(2S)-1-[di(propan-2-yl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-[di(propan-2-yl)amino]-1-oxopropan-2-yl] 2,6-dimethylquinoline-4-carboxylate Traditional Name: 2,6-dimethylcinchoninic acid [(1S)-2-(diisopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(C=C2C(=O)OC(C)C(=O)N(C(C)C)C(C)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(C=C2C(=O)O[C@@H](C)C(=O)N(C(C)C)C(C)C)C

InChI

InChI=1S/C21H28N2O3/c1-12(2)23(13(3)4)20(24)16(7)26-21(25)18-11-15(6)22-19-9-8-14(5)10-17(18)19/h8-13,16H,1-7H3/t16-/m0/s1