2-[(5-ethyl-2-oxidanyl-phenyl)methyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(5-ethyl-2-oxidanyl-phenyl)methyl-methyl-amino]ethanoic acid Openeye Name: 2-[(5-ethyl-2-hydroxy-phenyl)methyl-methyl-amino]acetic acid CAS Name: 2-[(5-ethyl-2-hydroxyphenyl)methyl-methylamino]acetic acid IUPAC Name: 2-[(5-ethyl-2-hydroxyphenyl)methyl-methylamino]acetic acid Traditional Name: 2-[(5-ethyl-2-hydroxy-benzyl)-methyl-amino]acetic acid Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)O)CN(C)CC(=O)O

Isomeric SMILES

CCC1=CC(=C(C=C1)O)CN(C)CC(=O)O

InChI

InChI=1S/C12H17NO3/c1-3-9-4-5-11(14)10(6-9)7-13(2)8-12(15)16/h4-6,14H,3,7-8H2,1-2H3,(H,15,16)