2-(3,5-dimethylphenoxy)ethyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: 2-(3,5-dimethylphenoxy)ethyl 2-chloranyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: 2-(3,5-dimethylphenoxy)ethyl 2-chloro-5-morpholinosulfonyl-benzoate CAS Name: 2-chloro-5-(4-morpholinylsulfonyl)benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester IUPAC Name: 2-(3,5-dimethylphenoxy)ethyl 2-chloro-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-chloro-5-morpholinosulfonyl-benzoic acid 2-(3,5-dimethylphenoxy)ethyl ester Formula: C21H24ClNO6S MolecularWeight: 453.93636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24ClNO6S/c1-15-11-16(2)13-17(12-15)28-9-10-29-21(24)19-14-18(3-4-20(19)22)30(25,26)23-5-7-27-8-6-23/h3-4,11-14H,5-10H2,1-2H3