3-(2-bromanyl-4,6-dimethyl-phenyl)-5-fluoranyl-6-methyl-4-(prop-2-ynoxymethoxy)pyran-2-one

Systemtic Name: 3-(2-bromanyl-4,6-dimethyl-phenyl)-5-fluoranyl-6-methyl-4-(prop-2-ynoxymethoxy)pyran-2-one Openeye Name: 3-(2-bromo-4,6-dimethyl-phenyl)-5-fluoro-6-methyl-4-(prop-2-ynoxymethoxy)pyran-2-one CAS Name: 3-(2-bromo-4,6-dimethylphenyl)-5-fluoro-6-methyl-4-(prop-2-ynoxymethoxy)-2-pyranone IUPAC Name: 3-(2-bromo-4,6-dimethylphenyl)-5-fluoro-6-methyl-4-(prop-2-ynoxymethoxy)pyran-2-one Traditional Name: 3-(2-bromo-4,6-dimethyl-phenyl)-5-fluoro-6-methyl-4-(propargyloxymethoxy)pyran-2-one Formula: C18H16BrFO4 MolecularWeight: 395.219643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Br)C2=C(C(=C(OC2=O)C)F)OCOCC#C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Br)C2=C(C(=C(OC2=O)C)F)OCOCC#C)C

InChI

InChI=1S/C18H16BrFO4/c1-5-6-22-9-23-17-15(18(21)24-12(4)16(17)20)14-11(3)7-10(2)8-13(14)19/h1,7-8H,6,9H2,2-4H3