ethyl 1-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxidanylidene-butanoyl]piperidine-3-carboxylate

Systemtic Name: ethyl 1-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxidanylidene-butanoyl]piperidine-3-carboxylate Openeye Name: ethyl 1-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxo-butanoyl]piperidine-3-carboxylate CAS Name: 1-[4-[[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]amino]-1,4-dioxobutyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-oxobutanoyl]piperidine-3-carboxylate Traditional Name: 1-[4-[[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]amino]-4-keto-butanoyl]nipecotic acid ethyl ester Formula: C25H33FN4O4 MolecularWeight: 472.552323

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)CCC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)CCC(=O)NC2=CC(=NN2C3=CC=C(C=C3)F)C(C)(C)C

InChI

InChI=1S/C25H33FN4O4/c1-5-34-24(33)17-7-6-14-29(16-17)23(32)13-12-22(31)27-21-15-20(25(2,3)4)28-30(21)19-10-8-18(26)9-11-19/h8-11,15,17H,5-7,12-14,16H2,1-4H3,(H,27,31)