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

Systemtic Name: ethyl 1-[4-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-4-oxidanylidene-butanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[4-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-4-oxo-butanoyl]piperidine-4-carboxylate CAS Name: 1-[4-[(5-tert-butyl-2-phenyl-3-pyrazolyl)amino]-1,4-dioxobutyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[4-[(5-tert-butyl-2-phenylpyrazol-3-yl)amino]-4-oxobutanoyl]piperidine-4-carboxylate Traditional Name: 1-[4-[(5-tert-butyl-2-phenyl-pyrazol-3-yl)amino]-4-keto-butanoyl]isonipecotic acid ethyl ester Formula: C25H34N4O4 MolecularWeight: 454.56186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CCC(=O)NC2=CC(=NN2C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C25H34N4O4/c1-5-33-24(32)18-13-15-28(16-14-18)23(31)12-11-22(30)26-21-17-20(25(2,3)4)27-29(21)19-9-7-6-8-10-19/h6-10,17-18H,5,11-16H2,1-4H3,(H,26,30)