ethyl (2S)-3-methyl-2-[[(2S)-1-(2-phenylethanoyl)pyrrolidin-2-yl]carbonylamino]butanoate

Systemtic Name: ethyl (2S)-3-methyl-2-[[(2S)-1-(2-phenylethanoyl)pyrrolidin-2-yl]carbonylamino]butanoate Openeye Name: ethyl (2S)-3-methyl-2-[[(2S)-1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[oxo-[(2S)-1-(1-oxo-2-phenylethyl)-2-pyrrolidinyl]methyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl (2S)-3-methyl-2-[[(2S)-1-(2-phenylacetyl)pyrrolidine-2-carbonyl]amino]butanoate Traditional Name: (2S)-3-methyl-2-[[(2S)-1-(2-phenylacetyl)prolyl]amino]butyric acid ethyl ester Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)NC(=O)C1CCCN1C(=O)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H](C(C)C)NC(=O)[C@@H]1CCCN1C(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H28N2O4/c1-4-26-20(25)18(14(2)3)21-19(24)16-11-8-12-22(16)17(23)13-15-9-6-5-7-10-15/h5-7,9-10,14,16,18H,4,8,11-13H2,1-3H3,(H,21,24)/t16-,18-/m0/s1