(2S)-3-methyl-2-[[(2S)-5-oxidanylidene-1-phenylmethoxycarbonyl-pyrrolidin-2-yl]carbonylamino]butanoic acid

Systemtic Name: (2S)-3-methyl-2-[[(2S)-5-oxidanylidene-1-phenylmethoxycarbonyl-pyrrolidin-2-yl]carbonylamino]butanoic acid Openeye Name: (2S)-2-[[(2S)-1-benzyloxycarbonyl-5-oxo-pyrrolidine-2-carbonyl]amino]-3-methyl-butanoic acid CAS Name: (2S)-3-methyl-2-[[oxo-[(2S)-5-oxo-1-phenylmethoxycarbonyl-2-pyrrolidinyl]methyl]amino]butanoic acid IUPAC Name: (2S)-3-methyl-2-[[(2S)-5-oxo-1-phenylmethoxycarbonylpyrrolidine-2-carbonyl]amino]butanoic acid Traditional Name: (2S)-2-[[(2S)-1-carbobenzoxy-5-keto-prolyl]amino]-3-methyl-butyric acid Formula: C18H22N2O6 MolecularWeight: 362.37708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1CCC(=O)N1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)[C@@H](C(=O)O)NC(=O)[C@@H]1CCC(=O)N1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H22N2O6/c1-11(2)15(17(23)24)19-16(22)13-8-9-14(21)20(13)18(25)26-10-12-6-4-3-5-7-12/h3-7,11,13,15H,8-10H2,1-2H3,(H,19,22)(H,23,24)/t13-,15-/m0/s1