(3-fluoranyl-4-methoxy-phenyl)methyl 1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxylate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl 1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindole-5-carboxylate Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl 2-allyl-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-prop-2-enyl-5-isoindolecarboxylic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl 1,3-dioxo-2-prop-2-enylisoindole-5-carboxylate Traditional Name: 2-allyl-1,3-diketo-isoindoline-5-carboxylic acid (3-fluoro-4-methoxy-benzyl) ester Formula: C20H16FNO5 MolecularWeight: 369.343143

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)F

Isomeric SMILES

COC1=C(C=C(C=C1)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C)F

InChI

InChI=1S/C20H16FNO5/c1-3-8-22-18(23)14-6-5-13(10-15(14)19(22)24)20(25)27-11-12-4-7-17(26-2)16(21)9-12/h3-7,9-10H,1,8,11H2,2H3