2-(4-azanyl-3-ethyl-5-oxidanyl-phenyl)ethanoate

Systemtic Name: 2-(4-azanyl-3-ethyl-5-oxidanyl-phenyl)ethanoate Openeye Name: 2-(4-amino-3-ethyl-5-hydroxy-phenyl)acetate CAS Name: 2-(4-amino-3-ethyl-5-hydroxyphenyl)acetate IUPAC Name: 2-(4-amino-3-ethyl-5-hydroxyphenyl)acetate Traditional Name: 2-(4-amino-3-ethyl-5-hydroxy-phenyl)acetate Formula: C10H12NO3- MolecularWeight: 194.20718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC(=C1)CC(=O)[O-])O)N

Isomeric SMILES

CCC1=C(C(=CC(=C1)CC(=O)[O-])O)N

InChI

InChI=1S/C10H13NO3/c1-2-7-3-6(5-9(13)14)4-8(12)10(7)11/h3-4,12H,2,5,11H2,1H3,(H,13,14)/p-1