(2S)-1-[(2R)-2-(ethoxycarbonylamino)-2-phenyl-ethanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-2-(ethoxycarbonylamino)-2-phenyl-ethanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-(ethoxycarbonylamino)-2-phenyl-acetyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-2-(ethoxycarbonylamino)-1-oxo-2-phenylethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-2-(ethoxycarbonylamino)-2-phenylacetyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-(carbethoxyamino)-2-phenyl-acetyl]proline Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N2O5/c1-2-23-16(22)17-13(11-7-4-3-5-8-11)14(19)18-10-6-9-12(18)15(20)21/h3-5,7-8,12-13H,2,6,9-10H2,1H3,(H,17,22)(H,20,21)/t12-,13+/m0/s1