(2,6-dimethylphenyl) 4-methyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2,6-dimethylphenyl) 4-methyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2,6-dimethylphenyl) 4-methyl-3-morpholinosulfonyl-benzoate CAS Name: 4-methyl-3-(4-morpholinylsulfonyl)benzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-methyl-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methyl-3-morpholinosulfonyl-benzoic acid (2,6-dimethylphenyl) ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)C2=CC(=C(C=C2)C)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C20H23NO5S/c1-14-7-8-17(20(22)26-19-15(2)5-4-6-16(19)3)13-18(14)27(23,24)21-9-11-25-12-10-21/h4-8,13H,9-12H2,1-3H3