2-methylheptan-2-yl 2-carbonofluoridoylbenzoate

Systemtic Name: 2-methylheptan-2-yl 2-carbonofluoridoylbenzoate Openeye Name: 1,1-dimethylhexyl 2-fluorocarbonylbenzoate CAS Name: 2-carbonofluoridoylbenzoic acid 2-methylheptan-2-yl ester IUPAC Name: 2-methylheptan-2-yl 2-carbonofluoridoylbenzoate Traditional Name: 2-fluorocarbonylbenzoic acid 1,1-dimethylhexyl ester Formula: C16H21FO3 MolecularWeight: 280.334543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(C)OC(=O)C1=CC=CC=C1C(=O)F

Isomeric SMILES

CCCCCC(C)(C)OC(=O)C1=CC=CC=C1C(=O)F

InChI

InChI=1S/C16H21FO3/c1-4-5-8-11-16(2,3)20-15(19)13-10-7-6-9-12(13)14(17)18/h6-7,9-10H,4-5,8,11H2,1-3H3