4-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-2-oxidanyl-benzoate

Systemtic Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-2-oxidanyl-benzoate Openeye Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-2-hydroxy-benzoate CAS Name: 4-[(1-ethyl-5-methyl-4-pyrazolyl)methylamino]-2-hydroxybenzoate IUPAC Name: 4-[(1-ethyl-5-methylpyrazol-4-yl)methylamino]-2-hydroxybenzoate Traditional Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methylamino]-2-hydroxy-benzoate Formula: C14H16N3O3- MolecularWeight: 274.29514

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3/c1-3-17-9(2)10(8-16-17)7-15-11-4-5-12(14(19)20)13(18)6-11/h4-6,8,15,18H,3,7H2,1-2H3,(H,19,20)/p-1