(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(4-fluorophenyl)quinoline-4-carboxylate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl 2-(4-fluorophenyl)quinoline-4-carboxylate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl 2-(4-fluorophenyl)quinoline-4-carboxylate CAS Name: 2-(4-fluorophenyl)-4-quinolinecarboxylic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl 2-(4-fluorophenyl)quinoline-4-carboxylate Traditional Name: 2-(4-fluorophenyl)cinchoninic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C27H18FNO5 MolecularWeight: 455.433923

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC(=NC4=CC=CC=C43)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H18FNO5/c1-32-19-10-11-20-17(12-26(30)34-25(20)13-19)15-33-27(31)22-14-24(16-6-8-18(28)9-7-16)29-23-5-3-2-4-21(22)23/h2-14H,15H2,1H3