methyl (5S,6R)-7-iodanyl-5-[(4-methoxyphenyl)methoxy]-6-methyl-heptanoate

Systemtic Name: methyl (5S,6R)-7-iodanyl-5-[(4-methoxyphenyl)methoxy]-6-methyl-heptanoate Openeye Name: methyl (5S,6R)-7-iodo-5-[(4-methoxyphenyl)methoxy]-6-methyl-heptanoate CAS Name: (5S,6R)-7-iodo-5-[(4-methoxyphenyl)methoxy]-6-methylheptanoic acid methyl ester IUPAC Name: methyl (5S,6R)-7-iodo-5-[(4-methoxyphenyl)methoxy]-6-methylheptanoate Traditional Name: (5S,6R)-7-iodo-6-methyl-5-p-anisyloxy-enanthic acid methyl ester Formula: C17H25IO4 MolecularWeight: 420.28247

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Descriptors Computed from Structure

Canonical SMILES:

CC(CI)C(CCCC(=O)OC)OCC1=CC=C(C=C1)OC

Isomeric SMILES

C[C@@H](CI)[C@H](CCCC(=O)OC)OCC1=CC=C(C=C1)OC

InChI

InChI=1S/C17H25IO4/c1-13(11-18)16(5-4-6-17(19)21-3)22-12-14-7-9-15(20-2)10-8-14/h7-10,13,16H,4-6,11-12H2,1-3H3/t13-,16-/m0/s1