(2S)-2-[(2-azanyl-3-phenyl-propanoyl)amino]pentanedioic acid

Systemtic Name: (2S)-2-[(2-azanyl-3-phenyl-propanoyl)amino]pentanedioic acid Openeye Name: (2S)-2-[(2-amino-3-phenyl-propanoyl)amino]pentanedioic acid CAS Name: (2S)-2-[(2-amino-1-oxo-3-phenylpropyl)amino]pentanedioic acid IUPAC Name: (2S)-2-[(2-amino-3-phenylpropanoyl)amino]pentanedioic acid Traditional Name: (2S)-2-(phenylalanylamino)glutaric acid Formula: C14H18N2O5 MolecularWeight: 294.30312

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O5/c15-10(8-9-4-2-1-3-5-9)13(19)16-11(14(20)21)6-7-12(17)18/h1-5,10-11H,6-8,15H2,(H,16,19)(H,17,18)(H,20,21)/t10?,11-/m0/s1