(2,6-dimethylphenyl) 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2,6-dimethylphenyl) 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2,6-dimethylphenyl) 2-chloro-5-morpholinosulfonyl-benzoate CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)benzoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 2-chloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-chloro-5-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=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)Cl

Isomeric SMILES

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

InChI

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