5-chloranyl-2-methoxy-4-(2-pyrazol-1-ylethanoylamino)benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-(2-pyrazol-1-ylethanoylamino)benzoic acid Openeye Name: 5-chloro-2-methoxy-4-[(2-pyrazol-1-ylacetyl)amino]benzoic acid CAS Name: 5-chloro-2-methoxy-4-[[1-oxo-2-(1-pyrazolyl)ethyl]amino]benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-[(2-pyrazol-1-ylacetyl)amino]benzoic acid Traditional Name: 5-chloro-2-methoxy-4-[(2-pyrazol-1-ylacetyl)amino]benzoic acid Formula: C13H12ClN3O4 MolecularWeight: 309.70508

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)O)Cl)NC(=O)CN2C=CC=N2

Isomeric SMILES

COC1=CC(=C(C=C1C(=O)O)Cl)NC(=O)CN2C=CC=N2

InChI

InChI=1S/C13H12ClN3O4/c1-21-11-6-10(9(14)5-8(11)13(19)20)16-12(18)7-17-4-2-3-15-17/h2-6H,7H2,1H3,(H,16,18)(H,19,20)