ethyl 2-[2-(1,3-dioxolan-2-yl)phenyl]-6-iodanyl-3-(phenylsulfonylmethyl)hexanoate

Systemtic Name: ethyl 2-[2-(1,3-dioxolan-2-yl)phenyl]-6-iodanyl-3-(phenylsulfonylmethyl)hexanoate Openeye Name: ethyl 3-(benzenesulfonylmethyl)-2-[2-(1,3-dioxolan-2-yl)phenyl]-6-iodo-hexanoate CAS Name: 3-(benzenesulfonylmethyl)-2-[2-(1,3-dioxolan-2-yl)phenyl]-6-iodohexanoic acid ethyl ester IUPAC Name: ethyl 3-(benzenesulfonylmethyl)-2-[2-(1,3-dioxolan-2-yl)phenyl]-6-iodohexanoate Traditional Name: 3-(besylmethyl)-2-[2-(1,3-dioxolan-2-yl)phenyl]-6-iodo-hexanoic acid ethyl ester Formula: C24H29IO6S MolecularWeight: 572.45293

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1C2OCCO2)C(CCCI)CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1C2OCCO2)C(CCCI)CS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H29IO6S/c1-2-29-23(26)22(20-12-6-7-13-21(20)24-30-15-16-31-24)18(9-8-14-25)17-32(27,28)19-10-4-3-5-11-19/h3-7,10-13,18,22,24H,2,8-9,14-17H2,1H3