4-chloranyl-3-[(1,3,5-trimethylpyrazol-4-yl)carbonylamino]benzoate

Systemtic Name: 4-chloranyl-3-[(1,3,5-trimethylpyrazol-4-yl)carbonylamino]benzoate Openeye Name: 4-chloro-3-[(1,3,5-trimethylpyrazole-4-carbonyl)amino]benzoate CAS Name: 4-chloro-3-[[oxo-(1,3,5-trimethyl-4-pyrazolyl)methyl]amino]benzoate IUPAC Name: 4-chloro-3-[(1,3,5-trimethylpyrazole-4-carbonyl)amino]benzoate Traditional Name: 4-chloro-3-[(1,3,5-trimethylpyrazole-4-carbonyl)amino]benzoate Formula: C14H13ClN3O3- MolecularWeight: 306.72432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C(=O)NC2=C(C=CC(=C2)C(=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NN1C)C)C(=O)NC2=C(C=CC(=C2)C(=O)[O-])Cl

InChI

InChI=1S/C14H14ClN3O3/c1-7-12(8(2)18(3)17-7)13(19)16-11-6-9(14(20)21)4-5-10(11)15/h4-6H,1-3H3,(H,16,19)(H,20,21)/p-1