2-[2-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[2-(3-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[2-(3-fluoro-4-methoxy-phenyl)-2-oxo-ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[2-(3-fluoro-4-methoxyphenyl)-2-oxoethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[2-(3-fluoro-4-methoxy-phenyl)-2-keto-ethyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C17H16FNO4 MolecularWeight: 317.311643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)CN2C(=O)C3CC=CCC3C2=O)F

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)CN2C(=O)C3CC=CCC3C2=O)F

InChI

InChI=1S/C17H16FNO4/c1-23-15-7-6-10(8-13(15)18)14(20)9-19-16(21)11-4-2-3-5-12(11)17(19)22/h2-3,6-8,11-12H,4-5,9H2,1H3