methyl 2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]dodecanoate

Systemtic Name: methyl 2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]dodecanoate Openeye Name: methyl 2-[4-(4-benzyloxyphenyl)sulfonylphenoxy]dodecanoate CAS Name: 2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]dodecanoic acid methyl ester IUPAC Name: methyl 2-[4-(4-phenylmethoxyphenyl)sulfonylphenoxy]dodecanoate Traditional Name: 2-[4-(4-benzoxyphenyl)sulfonylphenoxy]lauric acid methyl ester Formula: C32H40O6S MolecularWeight: 552.7214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C(=O)OC)OC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCC(C(=O)OC)OC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C32H40O6S/c1-3-4-5-6-7-8-9-13-16-31(32(33)36-2)38-28-19-23-30(24-20-28)39(34,35)29-21-17-27(18-22-29)37-25-26-14-11-10-12-15-26/h10-12,14-15,17-24,31H,3-9,13,16,25H2,1-2H3