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

Systemtic Name: (4aR,8R,8aS)-8-(5-bromanyl-2-oxidanyl-phenyl)-7-ethenyl-3,8a-diphenyl-5,8-dihydro-4aH-naphthalene-1,4-dione Openeye Name: (4aR,8R,8aS)-8-(5-bromo-2-hydroxy-phenyl)-3,8a-diphenyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-dione CAS Name: (4aR,8R,8aS)-8-(5-bromo-2-hydroxyphenyl)-7-ethenyl-3,8a-diphenyl-5,8-dihydro-4aH-naphthalene-1,4-dione IUPAC Name: (4aR,8R,8aS)-8-(5-bromo-2-hydroxyphenyl)-7-ethenyl-3,8a-diphenyl-5,8-dihydro-4aH-naphthalene-1,4-dione Traditional Name: (4aR,8R,8aS)-8-(5-bromo-2-hydroxy-phenyl)-3,8a-diphenyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-quinone Formula: C30H23BrO3 MolecularWeight: 511.40582

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CCC2C(=O)C(=CC(=O)C2(C1C3=C(C=CC(=C3)Br)O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C=CC1=CC[C@H]2C(=O)C(=CC(=O)[C@]2([C@H]1C3=C(C=CC(=C3)Br)O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H23BrO3/c1-2-19-13-15-25-29(34)23(20-9-5-3-6-10-20)18-27(33)30(25,21-11-7-4-8-12-21)28(19)24-17-22(31)14-16-26(24)32/h2-14,16-18,25,28,32H,1,15H2/t25-,28+,30-/m0/s1