(4S,5R)-3-iodanyl-4-methoxy-2-phenyl-5-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzofuran

Systemtic Name: (4S,5R)-3-iodanyl-4-methoxy-2-phenyl-5-(phenylmethyl)-4,5,6,7-tetrahydro-1-benzofuran Openeye Name: (4S,5R)-5-benzyl-3-iodo-4-methoxy-2-phenyl-4,5,6,7-tetrahydrobenzofuran CAS Name: (4S,5R)-3-iodo-4-methoxy-2-phenyl-5-(phenylmethyl)-4,5,6,7-tetrahydrobenzofuran IUPAC Name: (4S,5R)-5-benzyl-3-iodo-4-methoxy-2-phenyl-4,5,6,7-tetrahydro-1-benzofuran Traditional Name: (4S,5R)-5-benzyl-3-iodo-4-methoxy-2-phenyl-4,5,6,7-tetrahydrobenzofuran Formula: C22H21IO2 MolecularWeight: 444.30541

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Descriptors Computed from Structure

Canonical SMILES:

COC1C(CCC2=C1C(=C(O2)C3=CC=CC=C3)I)CC4=CC=CC=C4

Isomeric SMILES

CO[C@H]1[C@H](CCC2=C1C(=C(O2)C3=CC=CC=C3)I)CC4=CC=CC=C4

InChI

InChI=1S/C22H21IO2/c1-24-21-17(14-15-8-4-2-5-9-15)12-13-18-19(21)20(23)22(25-18)16-10-6-3-7-11-16/h2-11,17,21H,12-14H2,1H3/t17-,21+/m1/s1