4-[2-(4-hydroxyphenyl)ethanoyl-methyl-amino]butanoic acid

Systemtic Name: 4-[2-(4-hydroxyphenyl)ethanoyl-methyl-amino]butanoic acid Openeye Name: 4-[[2-(4-hydroxyphenyl)acetyl]-methyl-amino]butanoic acid CAS Name: 4-[[2-(4-hydroxyphenyl)-1-oxoethyl]-methylamino]butanoic acid IUPAC Name: 4-[[2-(4-hydroxyphenyl)acetyl]-methylamino]butanoic acid Traditional Name: 4-[[2-(4-hydroxyphenyl)acetyl]-methyl-amino]butyric acid Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CCCC(=O)O)C(=O)CC1=CC=C(C=C1)O

Isomeric SMILES

CN(CCCC(=O)O)C(=O)CC1=CC=C(C=C1)O

InChI

InChI=1S/C13H17NO4/c1-14(8-2-3-13(17)18)12(16)9-10-4-6-11(15)7-5-10/h4-7,15H,2-3,8-9H2,1H3,(H,17,18)