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

Systemtic Name: (2,6-dimethylphenyl) 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2,6-dimethylphenyl) 4-chloro-3-morpholinosulfonyl-benzoate CAS Name: 4-chloro-3-(4-morpholinylsulfonyl)benzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 4-chloro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-chloro-3-morpholinosulfonyl-benzoic acid (2,6-dimethylphenyl) ester Formula: C19H20ClNO5S MolecularWeight: 409.8838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClNO5S/c1-13-4-3-5-14(2)18(13)26-19(22)15-6-7-16(20)17(12-15)27(23,24)21-8-10-25-11-9-21/h3-7,12H,8-11H2,1-2H3