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

Systemtic Name: O1-tert-butyl O2-[2-[(2-methyl-6-propan-2-yl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-(2-isopropyl-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-methyl-6-propan-2-ylanilino)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-(2-methyl-6-propan-2-ylanilino)-2-oxoethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-(2-isopropyl-6-methyl-anilino)-2-keto-ethyl] ester Formula: C22H32N2O5 MolecularWeight: 404.49988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(C)C)NC(=O)COC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(C)C)NC(=O)COC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C22H32N2O5/c1-14(2)16-10-7-9-15(3)19(16)23-18(25)13-28-20(26)17-11-8-12-24(17)21(27)29-22(4,5)6/h7,9-10,14,17H,8,11-13H2,1-6H3,(H,23,25)/t17-/m0/s1