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

Systemtic Name: 4-chloranyl-1-[(4-ethoxyphenoxy)methyl]pyrazole-3-carboxylic acid Openeye Name: 4-chloro-1-[(4-ethoxyphenoxy)methyl]pyrazole-3-carboxylic acid CAS Name: 4-chloro-1-[(4-ethoxyphenoxy)methyl]-3-pyrazolecarboxylic acid IUPAC Name: 4-chloro-1-[(4-ethoxyphenoxy)methyl]pyrazole-3-carboxylic acid Traditional Name: 4-chloro-1-[(4-ethoxyphenoxy)methyl]pyrazole-3-carboxylic acid Formula: C13H13ClN2O4 MolecularWeight: 296.70632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCN2C=C(C(=N2)C(=O)O)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)OCN2C=C(C(=N2)C(=O)O)Cl

InChI

InChI=1S/C13H13ClN2O4/c1-2-19-9-3-5-10(6-4-9)20-8-16-7-11(14)12(15-16)13(17)18/h3-7H,2,8H2,1H3,(H,17,18)