2-[1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethylamino]ethanoic acid

Systemtic Name: 2-[1-[5-(butanoylamino)-2-oxidanyl-phenyl]ethylamino]ethanoic acid Openeye Name: 2-[1-[5-(butanoylamino)-2-hydroxy-phenyl]ethylamino]acetic acid CAS Name: 2-[1-[2-hydroxy-5-(1-oxobutylamino)phenyl]ethylamino]acetic acid IUPAC Name: 2-[1-[5-(butanoylamino)-2-hydroxyphenyl]ethylamino]acetic acid Traditional Name: 2-[1-(5-butyramido-2-hydroxy-phenyl)ethylamino]acetic acid Formula: C14H20N2O4 MolecularWeight: 280.3196

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC(=C(C=C1)O)C(C)NCC(=O)O

Isomeric SMILES

CCCC(=O)NC1=CC(=C(C=C1)O)C(C)NCC(=O)O

InChI

InChI=1S/C14H20N2O4/c1-3-4-13(18)16-10-5-6-12(17)11(7-10)9(2)15-8-14(19)20/h5-7,9,15,17H,3-4,8H2,1-2H3,(H,16,18)(H,19,20)