4-[(2-ethylpyrazol-3-yl)methylamino]-2-oxidanyl-benzoate

Systemtic Name: 4-[(2-ethylpyrazol-3-yl)methylamino]-2-oxidanyl-benzoate Openeye Name: 4-[(2-ethylpyrazol-3-yl)methylamino]-2-hydroxy-benzoate CAS Name: 4-[(2-ethyl-3-pyrazolyl)methylamino]-2-hydroxybenzoate IUPAC Name: 4-[(2-ethylpyrazol-3-yl)methylamino]-2-hydroxybenzoate Traditional Name: 4-[(2-ethylpyrazol-3-yl)methylamino]-2-hydroxy-benzoate Formula: C13H14N3O3- MolecularWeight: 260.26856

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=CC=N1)CNC2=CC(=C(C=C2)C(=O)[O-])O

Isomeric SMILES

CCN1C(=CC=N1)CNC2=CC(=C(C=C2)C(=O)[O-])O

InChI

InChI=1S/C13H15N3O3/c1-2-16-10(5-6-15-16)8-14-9-3-4-11(13(18)19)12(17)7-9/h3-7,14,17H,2,8H2,1H3,(H,18,19)/p-1