tert-butyl 4-[2-(2-chlorophenyl)-4-(furan-2-ylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(2-chlorophenyl)-4-(furan-2-ylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-chlorophenyl)-4-(2-furylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate CAS Name: 4-[2-(2-chlorophenyl)-4-[(2-furanylmethylamino)-oxomethyl]-3-pyrazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(2-chlorophenyl)-4-(furan-2-ylmethylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[2-(2-chlorophenyl)-4-(2-furfurylcarbamoyl)pyrazol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H29ClN4O4 MolecularWeight: 484.97516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=CC=C3Cl)C(=O)NCC4=CC=CO4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=C(C=NN2C3=CC=CC=C3Cl)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C25H29ClN4O4/c1-25(2,3)34-24(32)29-12-10-17(11-13-29)22-19(23(31)27-15-18-7-6-14-33-18)16-28-30(22)21-9-5-4-8-20(21)26/h4-9,14,16-17H,10-13,15H2,1-3H3,(H,27,31)