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

Systemtic Name: (4aS,8R,8aR)-8a-bromanyl-7-ethenyl-8-(5-methoxy-2-oxidanyl-phenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione Openeye Name: (4aS,8R,8aR)-8a-bromo-8-(2-hydroxy-5-methoxy-phenyl)-3-methyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-dione CAS Name: (4aS,8R,8aR)-8a-bromo-7-ethenyl-8-(2-hydroxy-5-methoxyphenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione IUPAC Name: (4aS,8R,8aR)-8a-bromo-7-ethenyl-8-(2-hydroxy-5-methoxyphenyl)-3-methyl-5,8-dihydro-4aH-naphthalene-1,4-dione Traditional Name: (4aS,8R,8aR)-8a-bromo-8-(2-hydroxy-5-methoxy-phenyl)-3-methyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-quinone Formula: C20H19BrO4 MolecularWeight: 403.26646

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19BrO4/c1-4-12-5-7-15-19(24)11(2)9-17(23)20(15,21)18(12)14-10-13(25-3)6-8-16(14)22/h4-6,8-10,15,18,22H,1,7H2,2-3H3/t15-,18+,20+/m0/s1