(2S)-6-azanyl-2-[[(1S)-1-cyano-3-phenyl-propyl]amino]hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-[[(1S)-1-cyano-3-phenyl-propyl]amino]hexanoic acid Openeye Name: (2S)-6-amino-2-[[(1S)-1-cyano-3-phenyl-propyl]amino]hexanoic acid CAS Name: (2S)-6-amino-2-[[(1S)-1-cyano-3-phenylpropyl]amino]hexanoic acid IUPAC Name: (2S)-6-amino-2-[[(1S)-1-cyano-3-phenylpropyl]amino]hexanoic acid Traditional Name: (2S)-6-amino-2-[[(1S)-1-cyano-3-phenyl-propyl]amino]hexanoic acid Formula: C16H23N3O2 MolecularWeight: 289.37272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(C#N)NC(CCCCN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CC[C@@H](C#N)N[C@@H](CCCCN)C(=O)O

InChI

InChI=1S/C16H23N3O2/c17-11-5-4-8-15(16(20)21)19-14(12-18)10-9-13-6-2-1-3-7-13/h1-3,6-7,14-15,19H,4-5,8-11,17H2,(H,20,21)/t14-,15-/m0/s1