diethyl 2-acetamido-2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]propanedioate

Systemtic Name: diethyl 2-acetamido-2-[(6-fluoranyl-4H-1,3-benzodioxin-8-yl)methyl]propanedioate Openeye Name: diethyl 2-acetamido-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]propanedioate CAS Name: 2-acetamido-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-acetamido-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]propanedioate Traditional Name: 2-acetamido-2-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]malonic acid diethyl ester Formula: C18H22FNO7 MolecularWeight: 383.368183

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=C2C(=CC(=C1)F)COCO2)(C(=O)OCC)NC(=O)C

Isomeric SMILES

CCOC(=O)C(CC1=C2C(=CC(=C1)F)COCO2)(C(=O)OCC)NC(=O)C

InChI

InChI=1S/C18H22FNO7/c1-4-25-16(22)18(20-11(3)21,17(23)26-5-2)8-12-6-14(19)7-13-9-24-10-27-15(12)13/h6-7H,4-5,8-10H2,1-3H3,(H,20,21)