ethyl (2R)-2-[[(2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)pyrrolidin-2-yl]carbonylamino]-2-phenyl-ethanoate

Systemtic Name: ethyl (2R)-2-[[(2S)-1-(3,3-dimethyl-2-oxidanylidene-pentanoyl)pyrrolidin-2-yl]carbonylamino]-2-phenyl-ethanoate Openeye Name: ethyl (2R)-2-[[(2S)-1-(3,3-dimethyl-2-oxo-pentanoyl)pyrrolidine-2-carbonyl]amino]-2-phenyl-acetate CAS Name: (2R)-2-[[[(2S)-1-(3,3-dimethyl-1,2-dioxopentyl)-2-pyrrolidinyl]-oxomethyl]amino]-2-phenylacetic acid ethyl ester IUPAC Name: ethyl (2R)-2-[[(2S)-1-(3,3-dimethyl-2-oxopentanoyl)pyrrolidine-2-carbonyl]amino]-2-phenylacetate Traditional Name: (2R)-2-[[(2S)-1-(2-keto-3,3-dimethyl-pentanoyl)prolyl]amino]-2-phenyl-acetic acid ethyl ester Formula: C22H30N2O5 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C(=O)C(=O)N1CCCC1C(=O)NC(C2=CC=CC=C2)C(=O)OCC

Isomeric SMILES

CCC(C)(C)C(=O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C2=CC=CC=C2)C(=O)OCC

InChI

InChI=1S/C22H30N2O5/c1-5-22(3,4)18(25)20(27)24-14-10-13-16(24)19(26)23-17(21(28)29-6-2)15-11-8-7-9-12-15/h7-9,11-12,16-17H,5-6,10,13-14H2,1-4H3,(H,23,26)/t16-,17+/m0/s1