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

Systemtic Name: (4aR,8R,8aS)-7-ethenyl-8-(3-iodanyl-5-methoxy-4-oxidanyl-phenyl)-3,8a-diphenyl-5,8-dihydro-4aH-naphthalene-1,4-dione Openeye Name: (4aR,8R,8aS)-8-(4-hydroxy-3-iodo-5-methoxy-phenyl)-3,8a-diphenyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-dione CAS Name: (4aR,8R,8aS)-7-ethenyl-8-(4-hydroxy-3-iodo-5-methoxyphenyl)-3,8a-diphenyl-5,8-dihydro-4aH-naphthalene-1,4-dione IUPAC Name: (4aR,8R,8aS)-7-ethenyl-8-(4-hydroxy-3-iodo-5-methoxyphenyl)-3,8a-diphenyl-5,8-dihydro-4aH-naphthalene-1,4-dione Traditional Name: (4aR,8R,8aS)-8-(4-hydroxy-3-iodo-5-methoxy-phenyl)-3,8a-diphenyl-7-vinyl-5,8-dihydro-4aH-naphthalene-1,4-quinone Formula: C31H25IO4 MolecularWeight: 588.43227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C2C(=CCC3C2(C(=O)C=C(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C=C)I)O

Isomeric SMILES

COC1=C(C(=CC(=C1)[C@H]2C(=CC[C@@H]3[C@]2(C(=O)C=C(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C=C)I)O

InChI

InChI=1S/C31H25IO4/c1-3-19-14-15-24-29(34)23(20-10-6-4-7-11-20)18-27(33)31(24,22-12-8-5-9-13-22)28(19)21-16-25(32)30(35)26(17-21)36-2/h3-14,16-18,24,28,35H,1,15H2,2H3/t24-,28+,31-/m0/s1