dimethyl 1-(3-chloranyl-2-methyl-phenyl)-5-iodanyl-pyrazole-3,4-dicarboxylate

Systemtic Name: dimethyl 1-(3-chloranyl-2-methyl-phenyl)-5-iodanyl-pyrazole-3,4-dicarboxylate Openeye Name: dimethyl 1-(3-chloro-2-methyl-phenyl)-5-iodo-pyrazole-3,4-dicarboxylate CAS Name: 1-(3-chloro-2-methylphenyl)-5-iodopyrazole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1-(3-chloro-2-methylphenyl)-5-iodopyrazole-3,4-dicarboxylate Traditional Name: 1-(3-chloro-2-methyl-phenyl)-5-iodo-pyrazole-3,4-dicarboxylic acid dimethyl ester Formula: C14H12ClIN2O4 MolecularWeight: 434.61355

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=C(C(=N2)C(=O)OC)C(=O)OC)I

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=C(C(=N2)C(=O)OC)C(=O)OC)I

InChI

InChI=1S/C14H12ClIN2O4/c1-7-8(15)5-4-6-9(7)18-12(16)10(13(19)21-2)11(17-18)14(20)22-3/h4-6H,1-3H3