2,2-dimethylpropanoic acid; 3-[2-(methylamino)-1-oxidanyl-ethyl]phenol

Systemtic Name: 2,2-dimethylpropanoic acid; 3-[2-(methylamino)-1-oxidanyl-ethyl]phenol Openeye Name: 2,2-dimethylpropanoic acid; 3-[1-hydroxy-2-(methylamino)ethyl]phenol CAS Name: 2,2-dimethylpropanoic acid; 3-[1-hydroxy-2-(methylamino)ethyl]phenol IUPAC Name: 2,2-dimethylpropanoic acid; 3-[1-hydroxy-2-(methylamino)ethyl]phenol Traditional Name: 2,2-dimethylpropionic acid; 3-[1-hydroxy-2-(methylamino)ethyl]phenol Formula: C14H23NO4 MolecularWeight: 269.33672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)O.CNCC(C1=CC(=CC=C1)O)O

Isomeric SMILES

CC(C)(C)C(=O)O.CNCC(C1=CC(=CC=C1)O)O

InChI

InChI=1S/C9H13NO2.C5H10O2/c1-10-6-9(12)7-3-2-4-8(11)5-7;1-5(2,3)4(6)7/h2-5,9-12H,6H2,1H3;1-3H3,(H,6,7)