(2R,3R,4aS,8aR)-2-[(2,4-dichlorophenyl)methoxymethyl]-3-iodanyl-2-methyl-3,4,4a,5,6,7,8,8a-octahydrochromene

Systemtic Name: (2R,3R,4aS,8aR)-2-[(2,4-dichlorophenyl)methoxymethyl]-3-iodanyl-2-methyl-3,4,4a,5,6,7,8,8a-octahydrochromene Openeye Name: (2R,3R,4aS,8aR)-2-[(2,4-dichlorophenyl)methoxymethyl]-3-iodo-2-methyl-3,4,4a,5,6,7,8,8a-octahydrochromene CAS Name: (2R,3R,4aS,8aR)-2-[(2,4-dichlorophenyl)methoxymethyl]-3-iodo-2-methyl-3,4,4a,5,6,7,8,8a-octahydro-1-benzopyran IUPAC Name: (2R,3R,4aS,8aR)-2-[(2,4-dichlorophenyl)methoxymethyl]-3-iodo-2-methyl-3,4,4a,5,6,7,8,8a-octahydrochromene Traditional Name: (2R,3R,4aS,8aR)-2-[(2,4-dichlorobenzyl)oxymethyl]-3-iodo-2-methyl-3,4,4a,5,6,7,8,8a-octahydrochromene Formula: C18H23Cl2IO2 MolecularWeight: 469.18449

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2CCCCC2O1)I)COCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@]1([C@@H](C[C@@H]2CCCC[C@H]2O1)I)COCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H23Cl2IO2/c1-18(11-22-10-13-6-7-14(19)9-15(13)20)17(21)8-12-4-2-3-5-16(12)23-18/h6-7,9,12,16-17H,2-5,8,10-11H2,1H3/t12-,16+,17+,18+/m0/s1