4-(5-azanyl-4-methoxycarbonyl-pyrazol-1-yl)benzoic acid

Systemtic Name: 4-(5-azanyl-4-methoxycarbonyl-pyrazol-1-yl)benzoic acid Openeye Name: 4-(5-amino-4-methoxycarbonyl-pyrazol-1-yl)benzoic acid CAS Name: 4-(5-amino-4-methoxycarbonyl-1-pyrazolyl)benzoic acid IUPAC Name: 4-(5-amino-4-methoxycarbonylpyrazol-1-yl)benzoic acid Traditional Name: 4-(5-amino-4-carbomethoxy-pyrazol-1-yl)benzoic acid Formula: C12H11N3O4 MolecularWeight: 261.23344

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)O)N

Isomeric SMILES

COC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)O)N

InChI

InChI=1S/C12H11N3O4/c1-19-12(18)9-6-14-15(10(9)13)8-4-2-7(3-5-8)11(16)17/h2-6H,13H2,1H3,(H,16,17)