ethyl 4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxidanylidene-ethanoyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-oxo-acetyl]piperazine-1-carboxylate CAS Name: 4-[2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1,2-dioxoethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-oxoacetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-2-keto-acetyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C(=O)C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C20H24N4O4/c1-4-28-20(27)23-12-10-22(11-13-23)19(26)18(25)17-14(2)21-24(15(17)3)16-8-6-5-7-9-16/h5-9H,4,10-13H2,1-3H3