methyl 4-[5-methoxy-4-methyl-2-[2-(phenylsulfonyl)ethyl]phenyl]pentanoate

Systemtic Name: methyl 4-[5-methoxy-4-methyl-2-[2-(phenylsulfonyl)ethyl]phenyl]pentanoate Openeye Name: methyl 4-[2-[2-(benzenesulfonyl)ethyl]-5-methoxy-4-methyl-phenyl]pentanoate CAS Name: 4-[2-[2-(benzenesulfonyl)ethyl]-5-methoxy-4-methylphenyl]pentanoic acid methyl ester IUPAC Name: methyl 4-[2-[2-(benzenesulfonyl)ethyl]-5-methoxy-4-methylphenyl]pentanoate Traditional Name: 4-[2-(2-besylethyl)-5-methoxy-4-methyl-phenyl]valeric acid methyl ester Formula: C22H28O5S MolecularWeight: 404.51972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)CCS(=O)(=O)C2=CC=CC=C2)C(C)CCC(=O)OC)OC

Isomeric SMILES

CC1=C(C=C(C(=C1)CCS(=O)(=O)C2=CC=CC=C2)C(C)CCC(=O)OC)OC

InChI

InChI=1S/C22H28O5S/c1-16(10-11-22(23)27-4)20-15-21(26-3)17(2)14-18(20)12-13-28(24,25)19-8-6-5-7-9-19/h5-9,14-16H,10-13H2,1-4H3