methyl 4-[[1-(3-chloranyl-2-methyl-phenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]benzoate

Systemtic Name: methyl 4-[[1-(3-chloranyl-2-methyl-phenyl)-5-piperidin-4-yl-pyrazol-4-yl]carbonylamino]benzoate Openeye Name: methyl 4-[[1-(3-chloro-2-methyl-phenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(3-chloro-2-methylphenyl)-5-(4-piperidinyl)-4-pyrazolyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(3-chloro-2-methylphenyl)-5-piperidin-4-ylpyrazole-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(3-chloro-2-methyl-phenyl)-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzoic acid methyl ester Formula: C24H25ClN4O3 MolecularWeight: 452.9333

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)C(=O)OC)C4CCNCC4

Isomeric SMILES

CC1=C(C=CC=C1Cl)N2C(=C(C=N2)C(=O)NC3=CC=C(C=C3)C(=O)OC)C4CCNCC4

InChI

InChI=1S/C24H25ClN4O3/c1-15-20(25)4-3-5-21(15)29-22(16-10-12-26-13-11-16)19(14-27-29)23(30)28-18-8-6-17(7-9-18)24(31)32-2/h3-9,14,16,26H,10-13H2,1-2H3,(H,28,30)