[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propanoate CAS Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-4-pyrazolyl]propanoic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] 3-[1-(3-methoxyphenyl)-3,5-dimethylpyrazol-4-yl]propanoate Traditional Name: 3-[1-(3-methoxyphenyl)-3,5-dimethyl-pyrazol-4-yl]propionic acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C25H28N2O4 MolecularWeight: 420.50082

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)COC(=O)CCC2=C(N(N=C2C)C3=CC(=CC=C3)OC)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)COC(=O)CCC2=C(N(N=C2C)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C25H28N2O4/c1-5-19-9-11-20(12-10-19)24(28)16-31-25(29)14-13-23-17(2)26-27(18(23)3)21-7-6-8-22(15-21)30-4/h6-12,15H,5,13-14,16H2,1-4H3