1-[4-[[4-methoxy-3-(phenylsulfonyl)phenyl]methyl]-3,5-dimethyl-phenoxy]propan-2-one

Systemtic Name: 1-[4-[[4-methoxy-3-(phenylsulfonyl)phenyl]methyl]-3,5-dimethyl-phenoxy]propan-2-one Openeye Name: 1-[4-[[3-(benzenesulfonyl)-4-methoxy-phenyl]methyl]-3,5-dimethyl-phenoxy]propan-2-one CAS Name: 1-[4-[[3-(benzenesulfonyl)-4-methoxyphenyl]methyl]-3,5-dimethylphenoxy]-2-propanone IUPAC Name: 1-[4-[[3-(benzenesulfonyl)-4-methoxyphenyl]methyl]-3,5-dimethylphenoxy]propan-2-one Traditional Name: 1-[4-(3-besyl-4-methoxy-benzyl)-3,5-dimethyl-phenoxy]acetone Formula: C25H26O5S MolecularWeight: 438.53594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC2=CC(=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3)C)OCC(=O)C

Isomeric SMILES

CC1=CC(=CC(=C1CC2=CC(=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3)C)OCC(=O)C

InChI

InChI=1S/C25H26O5S/c1-17-12-21(30-16-19(3)26)13-18(2)23(17)14-20-10-11-24(29-4)25(15-20)31(27,28)22-8-6-5-7-9-22/h5-13,15H,14,16H2,1-4H3