(4aS,8R,8aR)-8a-bromanyl-7-ethenyl-8-(3-fluoranyl-2-oxidanyl-phenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione

Systemtic Name: (4aS,8R,8aR)-8a-bromanyl-7-ethenyl-8-(3-fluoranyl-2-oxidanyl-phenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione Openeye Name: (4aS,8R,8aR)-8a-bromo-8-(3-fluoro-2-hydroxy-phenyl)-3-methyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-dione CAS Name: (4aS,8R,8aR)-8a-bromo-7-ethenyl-8-(3-fluoro-2-hydroxyphenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione IUPAC Name: (4aS,8R,8aR)-8a-bromo-7-ethenyl-8-(3-fluoro-2-hydroxyphenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione Traditional Name: (4aS,8R,8aR)-8a-bromo-8-(3-fluoro-2-hydroxy-phenyl)-3-methyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-quinone Formula: C19H16BrFO3 MolecularWeight: 391.230943

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2(C(C1=O)CC=C(C2C3=C(C(=CC=C3)F)O)C=C)Br

Isomeric SMILES

CC1=CC(=O)[C@@]2([C@H](C1=O)CC=C([C@@H]2C3=C(C(=CC=C3)F)O)C=C)Br

InChI

InChI=1S/C19H16BrFO3/c1-3-11-7-8-13-17(23)10(2)9-15(22)19(13,20)16(11)12-5-4-6-14(21)18(12)24/h3-7,9,13,16,24H,1,8H2,2H3/t13-,16+,19+/m0/s1