3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propyl 3-oxidanylidenebutanoate

Systemtic Name: 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propyl 3-oxidanylidenebutanoate Openeye Name: 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propyl 3-oxobutanoate CAS Name: 3-oxobutanoic acid 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-pyrazolyl]propyl ester IUPAC Name: 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propyl 3-oxobutanoate Traditional Name: 3-ketobutyric acid 3-[5-(4-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-3-yl]propyl ester Formula: C23H23ClN2O4 MolecularWeight: 426.89272

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(=O)OCCCC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)CC(=O)OCCCC1=NN(C(=C1)C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)OC

InChI

InChI=1S/C23H23ClN2O4/c1-16(27)14-23(28)30-13-3-4-19-15-22(17-5-7-18(24)8-6-17)26(25-19)20-9-11-21(29-2)12-10-20/h5-12,15H,3-4,13-14H2,1-2H3