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

Systemtic Name: 3-[(3-chloranylpyrazolo[1,5-a]pyrimidin-2-yl)carbonylamino]-4-methyl-benzoic acid Openeye Name: 3-[(3-chloropyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4-methyl-benzoic acid CAS Name: 3-[[(3-chloro-2-pyrazolo[1,5-a]pyrimidinyl)-oxomethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[(3-chloropyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4-methylbenzoic acid Traditional Name: 3-[(3-chloropyrazolo[1,5-a]pyrimidine-2-carbonyl)amino]-4-methyl-benzoic acid Formula: C15H11ClN4O3 MolecularWeight: 330.72584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=NN3C=CC=NC3=C2Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=O)C2=NN3C=CC=NC3=C2Cl

InChI

InChI=1S/C15H11ClN4O3/c1-8-3-4-9(15(22)23)7-10(8)18-14(21)12-11(16)13-17-5-2-6-20(13)19-12/h2-7H,1H3,(H,18,21)(H,22,23)