tert-butyl 2-[3-(2-methylpropyl)-2-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]-3-oxidanyl-propanoate

Systemtic Name: tert-butyl 2-[3-(2-methylpropyl)-2-oxidanylidene-1-phenethyl-pyrrolidin-3-yl]-3-oxidanyl-propanoate Openeye Name: tert-butyl 3-hydroxy-2-(3-isobutyl-2-oxo-1-phenethyl-pyrrolidin-3-yl)propanoate CAS Name: 3-hydroxy-2-[3-(2-methylpropyl)-2-oxo-1-phenethyl-3-pyrrolidinyl]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-hydroxy-2-[3-(2-methylpropyl)-2-oxo-1-phenethylpyrrolidin-3-yl]propanoate Traditional Name: 3-hydroxy-2-(3-isobutyl-2-keto-1-phenethyl-pyrrolidin-3-yl)propionic acid tert-butyl ester Formula: C23H35NO4 MolecularWeight: 389.5283

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1(CCN(C1=O)CCC2=CC=CC=C2)C(CO)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)CC1(CCN(C1=O)CCC2=CC=CC=C2)C(CO)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H35NO4/c1-17(2)15-23(19(16-25)20(26)28-22(3,4)5)12-14-24(21(23)27)13-11-18-9-7-6-8-10-18/h6-10,17,19,25H,11-16H2,1-5H3