[4-[4-butyl-3-(diethylcarbamoyloxy)-5-oxidanylidene-2-phenyl-pyrazol-1-yl]phenyl] ethanoate

Systemtic Name: [4-[4-butyl-3-(diethylcarbamoyloxy)-5-oxidanylidene-2-phenyl-pyrazol-1-yl]phenyl] ethanoate Openeye Name: [4-[4-butyl-3-(diethylcarbamoyloxy)-5-oxo-2-phenyl-pyrazol-1-yl]phenyl] acetate CAS Name: acetic acid [4-[4-butyl-3-[diethylamino(oxo)methoxy]-5-oxo-2-phenyl-1-pyrazolyl]phenyl] ester IUPAC Name: [4-[4-butyl-3-(diethylcarbamoyloxy)-5-oxo-2-phenylpyrazol-1-yl]phenyl] acetate Traditional Name: acetic acid [4-[4-butyl-3-(diethylcarbamoyloxy)-5-keto-2-phenyl-3-pyrazolin-1-yl]phenyl] ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(N(N(C1=O)C2=CC=C(C=C2)OC(=O)C)C3=CC=CC=C3)OC(=O)N(CC)CC

Isomeric SMILES

CCCCC1=C(N(N(C1=O)C2=CC=C(C=C2)OC(=O)C)C3=CC=CC=C3)OC(=O)N(CC)CC

InChI

InChI=1S/C26H31N3O5/c1-5-8-14-23-24(31)28(21-15-17-22(18-16-21)33-19(4)30)29(20-12-10-9-11-13-20)25(23)34-26(32)27(6-2)7-3/h9-13,15-18H,5-8,14H2,1-4H3