4-azanyl-2-[3-(2-hydroxyphenyl)propanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[3-(2-hydroxyphenyl)propanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[3-(2-hydroxyphenyl)propanoylamino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[3-(2-hydroxyphenyl)-1-oxopropyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[3-(2-hydroxyphenyl)propanoylamino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[3-(2-hydroxyphenyl)propanoylamino]-4-keto-butyric acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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