tert-butyl 2-[3-(4-fluorophenyl)-1-oxidanyl-4-oxidanylidene-2-propan-2-yloxy-cyclobut-2-en-1-yl]-4H-pyridine-1-carboxylate

Systemtic Name: tert-butyl 2-[3-(4-fluorophenyl)-1-oxidanyl-4-oxidanylidene-2-propan-2-yloxy-cyclobut-2-en-1-yl]-4H-pyridine-1-carboxylate Openeye Name: tert-butyl 2-[3-(4-fluorophenyl)-1-hydroxy-2-isopropoxy-4-oxo-cyclobut-2-en-1-yl]-4H-pyridine-1-carboxylate CAS Name: 2-[3-(4-fluorophenyl)-1-hydroxy-4-oxo-2-propan-2-yloxy-1-cyclobut-2-enyl]-4H-pyridine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-(4-fluorophenyl)-1-hydroxy-4-oxo-2-propan-2-yloxycyclobut-2-en-1-yl]-4H-pyridine-1-carboxylate Traditional Name: 2-[3-(4-fluorophenyl)-1-hydroxy-2-isopropoxy-4-keto-cyclobut-2-en-1-yl]-4H-pyridine-1-carboxylic acid tert-butyl ester Formula: C23H26FNO5 MolecularWeight: 415.454643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(=O)C1(C2=CCC=CN2C(=O)OC(C)(C)C)O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)OC1=C(C(=O)C1(C2=CCC=CN2C(=O)OC(C)(C)C)O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H26FNO5/c1-14(2)29-20-18(15-9-11-16(24)12-10-15)19(26)23(20,28)17-8-6-7-13-25(17)21(27)30-22(3,4)5/h7-14,28H,6H2,1-5H3