[2-[1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[1-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-[1-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[1-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester IUPAC Name: [2-[1-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-keto-2-[1-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-2,5-dimethyl-pyrrol-3-yl]ethyl] ester Formula: C23H27N3O4 MolecularWeight: 409.47818

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(=O)C1=C(N(C(=C1)C)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

Isomeric SMILES

CCCC(=O)OCC(=O)C1=C(N(C(=C1)C)C2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C

InChI

InChI=1S/C23H27N3O4/c1-6-10-21(28)30-14-20(27)19-13-15(2)25(16(19)3)22-17(4)24(5)26(23(22)29)18-11-8-7-9-12-18/h7-9,11-13H,6,10,14H2,1-5H3