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

Systemtic Name: (2S)-5-azanyl-2-[[2-(4-hydroxyphenyl)-2-oxidanyl-ethyl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-5-amino-2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxo-pentanoic acid CAS Name: (2S)-5-amino-2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxopentanoic acid IUPAC Name: (2S)-5-amino-2-[[2-hydroxy-2-(4-hydroxyphenyl)ethyl]amino]-5-oxopentanoic acid Traditional Name: (2S)-5-amino-2-[[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(CCC(=O)N)C(=O)O)O)O

Isomeric SMILES

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

InChI

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