(4-tert-butylphenyl) (3R,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-pyrrolidine-1-carboxylate

Systemtic Name: (4-tert-butylphenyl) (3R,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]-2-oxidanylidene-pyrrolidine-1-carboxylate Openeye Name: (4-tert-butylphenyl) (3R,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]-2-oxo-pyrrolidine-1-carboxylate CAS Name: (3R,4R)-3-ethyl-4-[(3-methyl-4-imidazolyl)methyl]-2-oxo-1-pyrrolidinecarboxylic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) (3R,4R)-3-ethyl-4-[(3-methylimidazol-4-yl)methyl]-2-oxopyrrolidine-1-carboxylate Traditional Name: (3R,4R)-3-ethyl-2-keto-4-[(3-methylimidazol-4-yl)methyl]pyrrolidine-1-carboxylic acid (4-tert-butylphenyl) ester Formula: C22H29N3O3 MolecularWeight: 383.48396

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(CN(C1=O)C(=O)OC2=CC=C(C=C2)C(C)(C)C)CC3=CN=CN3C

Isomeric SMILES

CC[C@@H]1[C@H](CN(C1=O)C(=O)OC2=CC=C(C=C2)C(C)(C)C)CC3=CN=CN3C

InChI

InChI=1S/C22H29N3O3/c1-6-19-15(11-17-12-23-14-24(17)5)13-25(20(19)26)21(27)28-18-9-7-16(8-10-18)22(2,3)4/h7-10,12,14-15,19H,6,11,13H2,1-5H3/t15-,19+/m0/s1