dimethyl 5-[[1-(2,4-dimethylphenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[[1-(2,4-dimethylphenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[1-(2,4-dimethylphenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[[1-(2,4-dimethylphenyl)-5-(4-piperidinyl)-4-pyrazolyl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[1-(2,4-dimethylphenyl)-5-piperidin-4-ylpyrazole-4-carbonyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[1-(2,4-dimethylphenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C27H30N4O5 MolecularWeight: 490.5509

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)C4CCNCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)NC3=CC(=CC(=C3)C(=O)OC)C(=O)OC)C4CCNCC4)C

InChI

InChI=1S/C27H30N4O5/c1-16-5-6-23(17(2)11-16)31-24(18-7-9-28-10-8-18)22(15-29-31)25(32)30-21-13-19(26(33)35-3)12-20(14-21)27(34)36-4/h5-6,11-15,18,28H,7-10H2,1-4H3,(H,30,32)