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

Systemtic Name: 2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methoxy]benzoic acid Openeye Name: 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methoxy]benzoic acid CAS Name: 2-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methoxy]benzoic acid IUPAC Name: 2-[(5-chloro-1,3-dimethylpyrazol-4-yl)methoxy]benzoic acid Traditional Name: 2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methoxy]benzoic acid Formula: C13H13ClN2O3 MolecularWeight: 280.70692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1COC2=CC=CC=C2C(=O)O)Cl)C

Isomeric SMILES

CC1=NN(C(=C1COC2=CC=CC=C2C(=O)O)Cl)C

InChI

InChI=1S/C13H13ClN2O3/c1-8-10(12(14)16(2)15-8)7-19-11-6-4-3-5-9(11)13(17)18/h3-6H,7H2,1-2H3,(H,17,18)