(2R,4S)-5-[(1S)-1-acetamido-2-(phenethylamino)ethyl]-4-ethenyl-pyrrolidine-2-carboxylic acid

Systemtic Name: (2R,4S)-5-[(1S)-1-acetamido-2-(phenethylamino)ethyl]-4-ethenyl-pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-5-[(1S)-1-acetamido-2-(phenethylamino)ethyl]-4-vinyl-pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-5-[(1S)-1-acetamido-2-(phenethylamino)ethyl]-4-ethenyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-5-[(1S)-1-acetamido-2-(phenethylamino)ethyl]-4-ethenylpyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-5-[(1S)-1-acetamido-2-(phenethylamino)ethyl]-4-vinyl-proline Formula: C19H27N3O3 MolecularWeight: 345.43598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CNCCC1=CC=CC=C1)C2C(CC(N2)C(=O)O)C=C

Isomeric SMILES

CC(=O)N[C@@H](CNCCC1=CC=CC=C1)C2[C@@H](C[C@@H](N2)C(=O)O)C=C

InChI

InChI=1S/C19H27N3O3/c1-3-15-11-16(19(24)25)22-18(15)17(21-13(2)23)12-20-10-9-14-7-5-4-6-8-14/h3-8,15-18,20,22H,1,9-12H2,2H3,(H,21,23)(H,24,25)/t15-,16-,17+,18?/m1/s1