tert-butyl (2S)-2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl (2S)-2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl (2S)-2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]pyrrolidine-1-carboxylate CAS Name: (2S)-2-[(5-tert-butyl-2-methoxyanilino)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[(5-tert-butyl-2-methoxyphenyl)carbamoyl]pyrrolidine-1-carboxylate Traditional Name: (2S)-2-[(5-tert-butyl-2-methoxy-phenyl)carbamoyl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C21H32N2O4 MolecularWeight: 376.48978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32N2O4/c1-20(2,3)14-10-11-17(26-7)15(13-14)22-18(24)16-9-8-12-23(16)19(25)27-21(4,5)6/h10-11,13,16H,8-9,12H2,1-7H3,(H,22,24)/t16-/m0/s1