methyl 4-[4-(2-acetamidoethyl)phenoxy]-2-methyl-5-methylsulfonyl-benzoate

Systemtic Name: methyl 4-[4-(2-acetamidoethyl)phenoxy]-2-methyl-5-methylsulfonyl-benzoate Openeye Name: methyl 4-[4-(2-acetamidoethyl)phenoxy]-2-methyl-5-methylsulfonyl-benzoate CAS Name: 4-[4-(2-acetamidoethyl)phenoxy]-2-methyl-5-methylsulfonylbenzoic acid methyl ester IUPAC Name: methyl 4-[4-(2-acetamidoethyl)phenoxy]-2-methyl-5-methylsulfonylbenzoate Traditional Name: 4-[4-(2-acetamidoethyl)phenoxy]-5-mesyl-2-methyl-benzoic acid methyl ester Formula: C20H23NO6S MolecularWeight: 405.46472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)OC2=CC=C(C=C2)CCNC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)OC2=CC=C(C=C2)CCNC(=O)C

InChI

InChI=1S/C20H23NO6S/c1-13-11-18(19(28(4,24)25)12-17(13)20(23)26-3)27-16-7-5-15(6-8-16)9-10-21-14(2)22/h5-8,11-12H,9-10H2,1-4H3,(H,21,22)