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

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

Systemtic Name:(2S)-2-[[(2S)-2-azanyl-3-phenyl-propanoyl]amino]butanedioic acid
Openeye Name:(2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]butanedioic acid
CAS Name:(2S)-2-[[(2S)-2-amino-1-oxo-3-phenylpropyl]amino]butanedioic acid
IUPAC Name:(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]butanedioic acid
Traditional Name:(2S)-2-[[(2S)-2-amino-3-phenyl-propanoyl]amino]succinic acid
Formula: C13H16N2O5
MolecularWeight: 280.27654
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H16N2O5/c14-9(6-8-4-2-1-3-5-8)12(18)15-10(13(19)20)7-11(16)17/h1-5,9-10H,6-7,14H2,(H,15,18)(H,16,17)(H,19,20)/t9-,10-/m0/s1


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