ethyl 2-ethoxy-3-[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]-3-(phenylmethyl)phenyl]propanoate

Systemtic Name: ethyl 2-ethoxy-3-[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]-3-(phenylmethyl)phenyl]propanoate Openeye Name: ethyl 3-[3-benzyl-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]-2-ethoxy-propanoate CAS Name: 2-ethoxy-3-[4-[2-(4-methylsulfonyloxyphenyl)ethoxy]-3-(phenylmethyl)phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[3-benzyl-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]-2-ethoxypropanoate Traditional Name: 3-[3-benzyl-4-[2-(4-methylsulfonyloxyphenyl)ethoxy]phenyl]-2-ethoxy-propionic acid ethyl ester Formula: C29H34O7S MolecularWeight: 526.64106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CC1=CC(=C(C=C1)OCCC2=CC=C(C=C2)OS(=O)(=O)C)CC3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(CC1=CC(=C(C=C1)OCCC2=CC=C(C=C2)OS(=O)(=O)C)CC3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C29H34O7S/c1-4-33-28(29(30)34-5-2)21-24-13-16-27(25(20-24)19-23-9-7-6-8-10-23)35-18-17-22-11-14-26(15-12-22)36-37(3,31)32/h6-16,20,28H,4-5,17-19,21H2,1-3H3