methyl 5-chloranyl-4-[(E)-(4-methylphenyl)methoxyiminomethyl]-1-phenyl-pyrazole-3-carboxylate

Systemtic Name: methyl 5-chloranyl-4-[(E)-(4-methylphenyl)methoxyiminomethyl]-1-phenyl-pyrazole-3-carboxylate Openeye Name: methyl 5-chloro-1-phenyl-4-[(E)-p-tolylmethoxyiminomethyl]pyrazole-3-carboxylate CAS Name: 5-chloro-4-[(E)-(4-methylphenyl)methoxyiminomethyl]-1-phenyl-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-chloro-4-[(E)-(4-methylphenyl)methoxyiminomethyl]-1-phenylpyrazole-3-carboxylate Traditional Name: 5-chloro-4-[(E)-(4-methylbenzyl)oximinomethyl]-1-phenyl-pyrazole-3-carboxylic acid methyl ester Formula: C20H18ClN3O3 MolecularWeight: 383.82822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CON=CC2=C(N(N=C2C(=O)OC)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CO/N=C/C2=C(N(N=C2C(=O)OC)C3=CC=CC=C3)Cl

InChI

InChI=1S/C20H18ClN3O3/c1-14-8-10-15(11-9-14)13-27-22-12-17-18(20(25)26-2)23-24(19(17)21)16-6-4-3-5-7-16/h3-12H,13H2,1-2H3/b22-12+