O1-tert-butyl O2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-[2-[(3-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-[2-(3-chloro-2-methyl-anilino)-2-oxo-ethyl] (2S)-pyrrolidine-1,2-dicarboxylate CAS Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-(3-chloro-2-methylanilino)-2-oxoethyl] ester IUPAC Name: 1-O-tert-butyl 2-O-[2-(3-chloro-2-methylanilino)-2-oxoethyl] (2S)-pyrrolidine-1,2-dicarboxylate Traditional Name: (2S)-pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-[2-(3-chloro-2-methyl-anilino)-2-keto-ethyl] ester Formula: C19H25ClN2O5 MolecularWeight: 396.8652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)COC(=O)C2CCCN2C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)COC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C

InChI

InChI=1S/C19H25ClN2O5/c1-12-13(20)7-5-8-14(12)21-16(23)11-26-17(24)15-9-6-10-22(15)18(25)27-19(2,3)4/h5,7-8,15H,6,9-11H2,1-4H3,(H,21,23)/t15-/m0/s1