4-[(3-ethoxy-4-oxidanyl-phenyl)methylamino]-1-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[(3-ethoxy-4-oxidanyl-phenyl)methylamino]-1-methyl-pyrazole-3-carboxylic acid Openeye Name: 4-[(3-ethoxy-4-hydroxy-phenyl)methylamino]-1-methyl-pyrazole-3-carboxylic acid CAS Name: 4-[(3-ethoxy-4-hydroxyphenyl)methylamino]-1-methyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[(3-ethoxy-4-hydroxyphenyl)methylamino]-1-methylpyrazole-3-carboxylic acid Traditional Name: 4-[(3-ethoxy-4-hydroxy-benzyl)amino]-1-methyl-pyrazole-3-carboxylic acid Formula: C14H17N3O4 MolecularWeight: 291.30248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CNC2=CN(N=C2C(=O)O)C)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)CNC2=CN(N=C2C(=O)O)C)O

InChI

InChI=1S/C14H17N3O4/c1-3-21-12-6-9(4-5-11(12)18)7-15-10-8-17(2)16-13(10)14(19)20/h4-6,8,15,18H,3,7H2,1-2H3,(H,19,20)