(2S)-2-azanyl-5-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: (2S)-2-azanyl-5-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-amino-5-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-2-amino-5-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-2-amino-5-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxopentanoic acid Traditional Name: (2S)-2-amino-5-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-5-keto-valeric acid Formula: C13H18N2O5 MolecularWeight: 282.29242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(CNC(=O)CCC(C(=O)O)N)O)O

Isomeric SMILES

C1=CC(=CC=C1C(CNC(=O)CC[C@@H](C(=O)O)N)O)O

InChI

InChI=1S/C13H18N2O5/c14-10(13(19)20)5-6-12(18)15-7-11(17)8-1-3-9(16)4-2-8/h1-4,10-11,16-17H,5-7,14H2,(H,15,18)(H,19,20)/t10-,11?/m0/s1