15-(3-iodanylphenyl)-2-[(2-methylphenyl)methyl]pentadecane-1,2,3-triol

Systemtic Name: 15-(3-iodanylphenyl)-2-[(2-methylphenyl)methyl]pentadecane-1,2,3-triol Openeye Name: 15-(3-iodophenyl)-2-(o-tolylmethyl)pentadecane-1,2,3-triol CAS Name: 15-(3-iodophenyl)-2-[(2-methylphenyl)methyl]pentadecane-1,2,3-triol IUPAC Name: 15-(3-iodophenyl)-2-[(2-methylphenyl)methyl]pentadecane-1,2,3-triol Traditional Name: 15-(3-iodophenyl)-2-(2-methylbenzyl)pentadecane-1,2,3-triol Formula: C29H43IO3 MolecularWeight: 566.55439

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(CO)(C(CCCCCCCCCCCCC2=CC(=CC=C2)I)O)O

Isomeric SMILES

CC1=CC=CC=C1CC(CO)(C(CCCCCCCCCCCCC2=CC(=CC=C2)I)O)O

InChI

InChI=1S/C29H43IO3/c1-24-15-12-13-18-26(24)22-29(33,23-31)28(32)20-11-9-7-5-3-2-4-6-8-10-16-25-17-14-19-27(30)21-25/h12-15,17-19,21,28,31-33H,2-11,16,20,22-23H2,1H3