3-chloranyl-4-[2-(4-chlorophenyl)-4-methyl-5-(piperidin-1-ylcarbamoyl)pyrazol-3-yl]benzoic acid

Systemtic Name: 3-chloranyl-4-[2-(4-chlorophenyl)-4-methyl-5-(piperidin-1-ylcarbamoyl)pyrazol-3-yl]benzoic acid Openeye Name: 3-chloro-4-[2-(4-chlorophenyl)-4-methyl-5-(1-piperidylcarbamoyl)pyrazol-3-yl]benzoic acid CAS Name: 3-chloro-4-[2-(4-chlorophenyl)-4-methyl-5-[oxo-(1-piperidinylamino)methyl]-3-pyrazolyl]benzoic acid IUPAC Name: 3-chloro-4-[2-(4-chlorophenyl)-4-methyl-5-(piperidin-1-ylcarbamoyl)pyrazol-3-yl]benzoic acid Traditional Name: 3-chloro-4-[2-(4-chlorophenyl)-4-methyl-5-(piperidinocarbamoyl)pyrazol-3-yl]benzoic acid Formula: C23H22Cl2N4O3 MolecularWeight: 473.35178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=CC=C(C=C3)Cl)C4=C(C=C(C=C4)C(=O)O)Cl

Isomeric SMILES

CC1=C(N(N=C1C(=O)NN2CCCCC2)C3=CC=C(C=C3)Cl)C4=C(C=C(C=C4)C(=O)O)Cl

InChI

InChI=1S/C23H22Cl2N4O3/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(17-8-6-16(24)7-9-17)21(14)18-10-5-15(23(31)32)13-19(18)25/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)(H,31,32)