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

Systemtic Name: (2R,4S)-5-[(1S)-1-acetamido-2-[(phenylmethyl)amino]ethyl]-4-ethenyl-pyrrolidine-2-carboxylic acid Openeye Name: (2R,4S)-5-[(1S)-1-acetamido-2-(benzylamino)ethyl]-4-vinyl-pyrrolidine-2-carboxylic acid CAS Name: (2R,4S)-5-[(1S)-1-acetamido-2-[(phenylmethyl)amino]ethyl]-4-ethenyl-2-pyrrolidinecarboxylic acid IUPAC Name: (2R,4S)-5-[(1S)-1-acetamido-2-(benzylamino)ethyl]-4-ethenylpyrrolidine-2-carboxylic acid Traditional Name: (2R,4S)-5-[(1S)-1-acetamido-2-(benzylamino)ethyl]-4-vinyl-proline Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CNCC1=CC=CC=C1)C2C(CC(N2)C(=O)O)C=C

Isomeric SMILES

CC(=O)N[C@@H](CNCC1=CC=CC=C1)C2[C@@H](C[C@@H](N2)C(=O)O)C=C

InChI

InChI=1S/C18H25N3O3/c1-3-14-9-15(18(23)24)21-17(14)16(20-12(2)22)11-19-10-13-7-5-4-6-8-13/h3-8,14-17,19,21H,1,9-11H2,2H3,(H,20,22)(H,23,24)/t14-,15-,16+,17?/m1/s1