(2S)-1-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenyl-ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-(tert-butoxycarbonylamino)-2-phenyl-acetyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxo-2-phenylethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-(tert-butoxycarbonylamino)-2-phenyl-acetyl]proline Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC=C1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@H](C1=CC=CC=C1)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C18H24N2O5/c1-18(2,3)25-17(24)19-14(12-8-5-4-6-9-12)15(21)20-11-7-10-13(20)16(22)23/h4-6,8-9,13-14H,7,10-11H2,1-3H3,(H,19,24)(H,22,23)/t13-,14+/m0/s1