[(E)-(4-methoxyphenyl)methylideneamino] 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxylate

Systemtic Name: [(E)-(4-methoxyphenyl)methylideneamino] 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxylate Openeye Name: [(E)-(4-methoxyphenyl)methyleneamino] 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxylate CAS Name: 1-(4-chlorophenyl)-5-propyl-4-pyrazolecarboxylic acid [(E)-(4-methoxyphenyl)methylideneamino] ester IUPAC Name: [(E)-(4-methoxyphenyl)methylideneamino] 1-(4-chlorophenyl)-5-propylpyrazole-4-carboxylate Traditional Name: 1-(4-chlorophenyl)-5-propyl-pyrazole-4-carboxylic acid [(E)-p-anisylideneamino] ester Formula: C21H20ClN3O3 MolecularWeight: 397.8548

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)ON=CC3=CC=C(C=C3)OC

Isomeric SMILES

CCCC1=C(C=NN1C2=CC=C(C=C2)Cl)C(=O)O/N=C/C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20ClN3O3/c1-3-4-20-19(14-23-25(20)17-9-7-16(22)8-10-17)21(26)28-24-13-15-5-11-18(27-2)12-6-15/h5-14H,3-4H2,1-2H3/b24-13+