(3,5-dimethylphenyl) 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3,5-dimethylphenyl) 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3,5-dimethylphenyl) 4-chloro-3-morpholinosulfonyl-benzoate CAS Name: 4-chloro-3-(4-morpholinylsulfonyl)benzoic acid (3,5-dimethylphenyl) ester IUPAC Name: (3,5-dimethylphenyl) 4-chloro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-chloro-3-morpholinosulfonyl-benzoic acid (3,5-dimethylphenyl) ester Formula: C19H20ClNO5S MolecularWeight: 409.8838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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