methyl (2S)-2-azanyl-5-[(4-hydroxyphenyl)amino]-5-oxidanylidene-pentanoate

Systemtic Name: methyl (2S)-2-azanyl-5-[(4-hydroxyphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: methyl (2S)-2-amino-5-(4-hydroxyanilino)-5-oxo-pentanoate CAS Name: (2S)-2-amino-5-(4-hydroxyanilino)-5-oxopentanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-5-(4-hydroxyanilino)-5-oxopentanoate Traditional Name: (2S)-2-amino-5-(4-hydroxyanilino)-5-keto-valeric acid methyl ester Formula: C12H16N2O4 MolecularWeight: 252.26644

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC(=O)NC1=CC=C(C=C1)O)N

Isomeric SMILES

COC(=O)[C@H](CCC(=O)NC1=CC=C(C=C1)O)N

InChI

InChI=1S/C12H16N2O4/c1-18-12(17)10(13)6-7-11(16)14-8-2-4-9(15)5-3-8/h2-5,10,15H,6-7,13H2,1H3,(H,14,16)/t10-/m0/s1