ethyl 3-[[5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl]amino]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[[5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl]amino]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[[5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl]amino]-3-oxo-propanoate CAS Name: 3-[[5-tert-butyl-2-(3-fluorophenyl)-3-pyrazolyl]amino]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[[5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl]amino]-3-oxopropanoate Traditional Name: 3-[[5-tert-butyl-2-(3-fluorophenyl)pyrazol-3-yl]amino]-3-keto-propionic acid ethyl ester Formula: C18H22FN3O3 MolecularWeight: 347.383983

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)NC1=CC(=NN1C2=CC(=CC=C2)F)C(C)(C)C

Isomeric SMILES

CCOC(=O)CC(=O)NC1=CC(=NN1C2=CC(=CC=C2)F)C(C)(C)C

InChI

InChI=1S/C18H22FN3O3/c1-5-25-17(24)11-16(23)20-15-10-14(18(2,3)4)21-22(15)13-8-6-7-12(19)9-13/h6-10H,5,11H2,1-4H3,(H,20,23)