5-[[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]amino]hexanoic acid

Systemtic Name: 5-[[2-[3,4-bis(oxidanyl)phenyl]-2-oxidanyl-ethyl]amino]hexanoic acid Openeye Name: 5-[[2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]amino]hexanoic acid CAS Name: 5-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]hexanoic acid IUPAC Name: 5-[[2-(3,4-dihydroxyphenyl)-2-hydroxyethyl]amino]hexanoic acid Traditional Name: 5-[[2-(3,4-dihydroxyphenyl)-2-hydroxy-ethyl]amino]hexanoic acid Formula: C14H21NO5 MolecularWeight: 283.32024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO5/c1-9(3-2-4-14(19)20)15-8-13(18)10-5-6-11(16)12(17)7-10/h5-7,9,13,15-18H,2-4,8H2,1H3,(H,19,20)