O1-tert-butyl O2-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-(2-ethyl-6-methylanilino)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-(2-ethyl-6-methylanilino)-2-oxoethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C21H30N2O5 MolecularWeight: 390.4733

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)COC(=O)C2CCCN2C(=O)OC(C)(C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)COC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)C

InChI

InChI=1S/C21H30N2O5/c1-6-15-10-7-9-14(2)18(15)22-17(24)13-27-19(25)16-11-8-12-23(16)20(26)28-21(3,4)5/h7,9-10,16H,6,8,11-13H2,1-5H3,(H,22,24)/t16-/m0/s1