(2S)-1-[(2R)-2-acetamido-3-(4-methoxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: (2S)-1-[(2R)-2-acetamido-3-(4-methoxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: (2S)-1-[(2R)-2-acetamido-3-(4-methoxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid CAS Name: (2S)-1-[(2R)-2-acetamido-3-(4-methoxyphenyl)-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: (2S)-1-[(2R)-2-acetamido-3-(4-methoxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: (2S)-1-[(2R)-2-acetamido-3-(4-methoxyphenyl)propanoyl]proline Formula: C17H22N2O5 MolecularWeight: 334.36698

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CC=C(C=C1)OC)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(=O)N[C@H](CC1=CC=C(C=C1)OC)C(=O)N2CCC[C@H]2C(=O)O

InChI

InChI=1S/C17H22N2O5/c1-11(20)18-14(10-12-5-7-13(24-2)8-6-12)16(21)19-9-3-4-15(19)17(22)23/h5-8,14-15H,3-4,9-10H2,1-2H3,(H,18,20)(H,22,23)/t14-,15+/m1/s1