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

Systemtic Name: (4aS,8R,8aR)-8a-bromanyl-7-ethenyl-3-methyl-8-(2-oxidanyl-4-phenylmethoxy-phenyl)-5,8-dihydro-4aH-naphthalene-1,4-dione Openeye Name: (4aS,8R,8aR)-8-(4-benzyloxy-2-hydroxy-phenyl)-8a-bromo-3-methyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-dione CAS Name: (4aS,8R,8aR)-8a-bromo-7-ethenyl-8-(2-hydroxy-4-phenylmethoxyphenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione IUPAC Name: (4aS,8R,8aR)-8a-bromo-7-ethenyl-8-(2-hydroxy-4-phenylmethoxyphenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione Traditional Name: (4aS,8R,8aR)-8-(4-benzoxy-2-hydroxy-phenyl)-8a-bromo-3-methyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-quinone Formula: C26H23BrO4 MolecularWeight: 479.36242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2(C(C1=O)CC=C(C2C3=C(C=C(C=C3)OCC4=CC=CC=C4)O)C=C)Br

Isomeric SMILES

CC1=CC(=O)[C@@]2([C@H](C1=O)CC=C([C@@H]2C3=C(C=C(C=C3)OCC4=CC=CC=C4)O)C=C)Br

InChI

InChI=1S/C26H23BrO4/c1-3-18-9-12-21-25(30)16(2)13-23(29)26(21,27)24(18)20-11-10-19(14-22(20)28)31-15-17-7-5-4-6-8-17/h3-11,13-14,21,24,28H,1,12,15H2,2H3/t21-,24+,26+/m0/s1