ethyl 1-[3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-methyl-1-(4-methylphenyl)-5-pyrrol-1-yl-pyrazol-4-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[3-methyl-1-(4-methylphenyl)-5-(1-pyrrolyl)-4-pyrazolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-methyl-1-(4-methylphenyl)-5-pyrrol-1-ylpyrazole-4-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[3-methyl-1-(p-tolyl)-5-pyrrol-1-yl-pyrazole-4-carbonyl]isonipecotic acid ethyl ester Formula: C24H28N4O3 MolecularWeight: 420.50412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)C)N4C=CC=C4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(N(N=C2C)C3=CC=C(C=C3)C)N4C=CC=C4

InChI

InChI=1S/C24H28N4O3/c1-4-31-24(30)19-11-15-27(16-12-19)23(29)21-18(3)25-28(20-9-7-17(2)8-10-20)22(21)26-13-5-6-14-26/h5-10,13-14,19H,4,11-12,15-16H2,1-3H3