4-[(3-chloranylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]benzoic acid

Systemtic Name: 4-[(3-chloranylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]benzoic acid Openeye Name: 4-[(3-chloropyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]benzoic acid CAS Name: 4-[[(3-chloro-2-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]benzoic acid IUPAC Name: 4-[(3-chloropyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]benzoic acid Traditional Name: 4-[(3-chloropyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]benzoic acid Formula: C14H9ClN4O3 MolecularWeight: 316.69926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN2C(=C(C(=N2)C(=O)NC3=CC=C(C=C3)C(=O)O)Cl)N=C1

Isomeric SMILES

C1=CN2C(=C(C(=N2)C(=O)NC3=CC=C(C=C3)C(=O)O)Cl)N=C1

InChI

InChI=1S/C14H9ClN4O3/c15-10-11(18-19-7-1-6-16-12(10)19)13(20)17-9-4-2-8(3-5-9)14(21)22/h1-7H,(H,17,20)(H,21,22)