1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazole-3-carboxylic acid

Systemtic Name: 1-[(4-chloranyl-3-methyl-phenoxy)methyl]pyrazole-3-carboxylic acid Openeye Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carboxylic acid CAS Name: 1-[(4-chloro-3-methylphenoxy)methyl]-3-pyrazolecarboxylic acid IUPAC Name: 1-[(4-chloro-3-methylphenoxy)methyl]pyrazole-3-carboxylic acid Traditional Name: 1-[(4-chloro-3-methyl-phenoxy)methyl]pyrazole-3-carboxylic acid Formula: C12H11ClN2O3 MolecularWeight: 266.68034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)O)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCN2C=CC(=N2)C(=O)O)Cl

InChI

InChI=1S/C12H11ClN2O3/c1-8-6-9(2-3-10(8)13)18-7-15-5-4-11(14-15)12(16)17/h2-6H,7H2,1H3,(H,16,17)