2-chloranyl-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]benzoic acid

Systemtic Name: 2-chloranyl-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]benzoic acid Openeye Name: 2-chloro-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]benzoic acid CAS Name: 2-chloro-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]benzoic acid IUPAC Name: 2-chloro-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]benzoic acid Traditional Name: 2-chloro-5-[(3,5-dimethyl-1H-pyrazol-4-yl)methylamino]benzoic acid Formula: C13H14ClN3O2 MolecularWeight: 279.72216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)CNC2=CC(=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CC1=C(C(=NN1)C)CNC2=CC(=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C13H14ClN3O2/c1-7-11(8(2)17-16-7)6-15-9-3-4-12(14)10(5-9)13(18)19/h3-5,15H,6H2,1-2H3,(H,16,17)(H,18,19)