3-methylbutyl 2-(6-ethynylnaphthalen-2-yl)-3,3-bis(fluoranyl)propanoate

Systemtic Name: 3-methylbutyl 2-(6-ethynylnaphthalen-2-yl)-3,3-bis(fluoranyl)propanoate Openeye Name: isopentyl 2-(6-ethynyl-2-naphthyl)-3,3-difluoro-propanoate CAS Name: 2-(6-ethynyl-2-naphthalenyl)-3,3-difluoropropanoic acid 3-methylbutyl ester IUPAC Name: 3-methylbutyl 2-(6-ethynylnaphthalen-2-yl)-3,3-difluoropropanoate Traditional Name: 2-(6-ethynyl-2-naphthyl)-3,3-difluoro-propionic acid isoamyl ester Formula: C20H20F2O2 MolecularWeight: 330.368406

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC(=O)C(C1=CC2=C(C=C1)C=C(C=C2)C#C)C(F)F

Isomeric SMILES

CC(C)CCOC(=O)C(C1=CC2=C(C=C1)C=C(C=C2)C#C)C(F)F

InChI

InChI=1S/C20H20F2O2/c1-4-14-5-6-16-12-17(8-7-15(16)11-14)18(19(21)22)20(23)24-10-9-13(2)3/h1,5-8,11-13,18-19H,9-10H2,2-3H3