ethyl 1-[2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazol-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[2-(2,4-dimethylphenyl)-5-(1-methyl-2-pyrrolyl)-3-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[2-(2,4-dimethylphenyl)-5-(1-methylpyrrol-2-yl)pyrazole-3-carbonyl]isonipecotic acid ethyl ester Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=C(C=C(C=C3)C)C)C4=CC=CN4C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC(=NN2C3=C(C=C(C=C3)C)C)C4=CC=CN4C

InChI

InChI=1S/C25H30N4O3/c1-5-32-25(31)19-10-13-28(14-11-19)24(30)23-16-20(22-7-6-12-27(22)4)26-29(23)21-9-8-17(2)15-18(21)3/h6-9,12,15-16,19H,5,10-11,13-14H2,1-4H3