methyl 6-[2-[5-[(4-fluorophenyl)methyl]furan-2-yl]-1-oxidanyl-3-oxidanylidene-prop-2-enyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[2-[5-[(4-fluorophenyl)methyl]furan-2-yl]-1-oxidanyl-3-oxidanylidene-prop-2-enyl]pyridine-3-carboxylate Openeye Name: methyl 6-[2-[5-[(4-fluorophenyl)methyl]-2-furyl]-1-hydroxy-3-oxo-allyl]pyridine-3-carboxylate CAS Name: 6-[2-[5-[(4-fluorophenyl)methyl]-2-furanyl]-1-hydroxy-3-oxoprop-2-enyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[2-[5-[(4-fluorophenyl)methyl]furan-2-yl]-1-hydroxy-3-oxoprop-2-enyl]pyridine-3-carboxylate Traditional Name: 6-[2-[5-(4-fluorobenzyl)-2-furyl]-1-hydroxy-3-keto-allyl]nicotinic acid methyl ester Formula: C21H16FNO5 MolecularWeight: 381.353843

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(C(=C=O)C2=CC=C(O2)CC3=CC=C(C=C3)F)O

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(C(=C=O)C2=CC=C(O2)CC3=CC=C(C=C3)F)O

InChI

InChI=1S/C21H16FNO5/c1-27-21(26)14-4-8-18(23-11-14)20(25)17(12-24)19-9-7-16(28-19)10-13-2-5-15(22)6-3-13/h2-9,11,20,25H,10H2,1H3