1-(2,4-dichlorophenyl)-4,5-diethyl-5-methoxycarbonyl-4H-pyrazole-3-carboxylic acid

Systemtic Name: 1-(2,4-dichlorophenyl)-4,5-diethyl-5-methoxycarbonyl-4H-pyrazole-3-carboxylic acid Openeye Name: 1-(2,4-dichlorophenyl)-4,5-diethyl-5-methoxycarbonyl-4H-pyrazole-3-carboxylic acid CAS Name: 1-(2,4-dichlorophenyl)-4,5-diethyl-5-methoxycarbonyl-4H-pyrazole-3-carboxylic acid IUPAC Name: 1-(2,4-dichlorophenyl)-4,5-diethyl-5-methoxycarbonyl-4H-pyrazole-3-carboxylic acid Traditional Name: 5-carbomethoxy-1-(2,4-dichlorophenyl)-4,5-diethyl-2-pyrazoline-3-carboxylic acid Formula: C16H18Cl2N2O4 MolecularWeight: 373.23112

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=NN(C1(CC)C(=O)OC)C2=C(C=C(C=C2)Cl)Cl)C(=O)O

Isomeric SMILES

CCC1C(=NN(C1(CC)C(=O)OC)C2=C(C=C(C=C2)Cl)Cl)C(=O)O

InChI

InChI=1S/C16H18Cl2N2O4/c1-4-10-13(14(21)22)19-20(16(10,5-2)15(23)24-3)12-7-6-9(17)8-11(12)18/h6-8,10H,4-5H2,1-3H3,(H,21,22)