6-[(5R)-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-fluoranyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-fluoranyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-fluoro-cyclohexa-2,4-dien-1-one CAS Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)-3-pyrazolidinylidene]-4-fluoro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-fluorocyclohexa-2,4-dien-1-one Traditional Name: 6-[(5R)-5-(3,4-dimethoxyphenyl)pyrazolidin-3-ylidene]-4-fluoro-cyclohexa-2,4-dien-1-one Formula: C17H17FN2O3 MolecularWeight: 316.326883

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=C3C=C(C=CC3=O)F)NN2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H]2CC(=C3C=C(C=CC3=O)F)NN2)OC

InChI

InChI=1S/C17H17FN2O3/c1-22-16-6-3-10(7-17(16)23-2)13-9-14(20-19-13)12-8-11(18)4-5-15(12)21/h3-8,13,19-20H,9H2,1-2H3/t13-/m1/s1