ethyl 2-[2-(2,4-dichlorophenyl)-4-methyl-5-(piperidin-1-ylcarbamoyl)pyrazol-3-yl]benzoate

Systemtic Name: ethyl 2-[2-(2,4-dichlorophenyl)-4-methyl-5-(piperidin-1-ylcarbamoyl)pyrazol-3-yl]benzoate Openeye Name: ethyl 2-[2-(2,4-dichlorophenyl)-4-methyl-5-(1-piperidylcarbamoyl)pyrazol-3-yl]benzoate CAS Name: 2-[2-(2,4-dichlorophenyl)-4-methyl-5-[oxo-(1-piperidinylamino)methyl]-3-pyrazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-[2-(2,4-dichlorophenyl)-4-methyl-5-(piperidin-1-ylcarbamoyl)pyrazol-3-yl]benzoate Traditional Name: 2-[2-(2,4-dichlorophenyl)-4-methyl-5-(piperidinocarbamoyl)pyrazol-3-yl]benzoic acid ethyl ester Formula: C25H26Cl2N4O3 MolecularWeight: 501.40494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NN4CCCCC4)C

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1C2=C(C(=NN2C3=C(C=C(C=C3)Cl)Cl)C(=O)NN4CCCCC4)C

InChI

InChI=1S/C25H26Cl2N4O3/c1-3-34-25(33)19-10-6-5-9-18(19)23-16(2)22(24(32)29-30-13-7-4-8-14-30)28-31(23)21-12-11-17(26)15-20(21)27/h5-6,9-12,15H,3-4,7-8,13-14H2,1-2H3,(H,29,32)