(2S)-3-(4-hydroxyphenyl)-2-[[(2S)-2-oxidanyl-3-phenyl-propanoyl]amino]propanoic acid

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-2-oxidanyl-3-phenyl-propanoyl]amino]propanoic acid Openeye Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-2-hydroxy-3-phenyl-propanoyl]amino]propanoic acid CAS Name: (2S)-2-[[(2S)-2-hydroxy-1-oxo-3-phenylpropyl]amino]-3-(4-hydroxyphenyl)propanoic acid IUPAC Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-2-hydroxy-3-phenylpropanoyl]amino]propanoic acid Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[[(2S)-2-hydroxy-3-phenyl-propanoyl]amino]propionic acid Formula: C18H19NO5 MolecularWeight: 329.34716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CC2=CC=C(C=C2)O)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CC2=CC=C(C=C2)O)C(=O)O)O

InChI

InChI=1S/C18H19NO5/c20-14-8-6-13(7-9-14)10-15(18(23)24)19-17(22)16(21)11-12-4-2-1-3-5-12/h1-9,15-16,20-21H,10-11H2,(H,19,22)(H,23,24)/t15-,16-/m0/s1