methyl 5-(4-chlorophenyl)-1-[N-cyclohexyl-C-(2-methoxyphenyl)carbonimidoyl]pyrazole-3-carboxylate

Systemtic Name: methyl 5-(4-chlorophenyl)-1-[N-cyclohexyl-C-(2-methoxyphenyl)carbonimidoyl]pyrazole-3-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-1-[N-cyclohexyl-C-(2-methoxyphenyl)carbonimidoyl]pyrazole-3-carboxylate CAS Name: 5-(4-chlorophenyl)-1-[cyclohexylimino-(2-methoxyphenyl)methyl]-3-pyrazolecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-1-[N-cyclohexyl-C-(2-methoxyphenyl)carbonimidoyl]pyrazole-3-carboxylate Traditional Name: 5-(4-chlorophenyl)-1-[N-cyclohexyl-C-(2-methoxyphenyl)carbonimidoyl]pyrazole-3-carboxylic acid methyl ester Formula: C25H26ClN3O3 MolecularWeight: 451.94524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=NC2CCCCC2)N3C(=CC(=N3)C(=O)OC)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1C(=NC2CCCCC2)N3C(=CC(=N3)C(=O)OC)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H26ClN3O3/c1-31-23-11-7-6-10-20(23)24(27-19-8-4-3-5-9-19)29-22(16-21(28-29)25(30)32-2)17-12-14-18(26)15-13-17/h6-7,10-16,19H,3-5,8-9H2,1-2H3