(3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-chloranyl-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 4-chloro-3-morpholinosulfonyl-benzoate CAS Name: 4-chloro-3-(4-morpholinylsulfonyl)benzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 4-chloro-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-chloro-3-morpholinosulfonyl-benzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C17H19ClN2O6S MolecularWeight: 414.86056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C17H19ClN2O6S/c1-11-14(12(2)26-19-11)10-25-17(21)13-3-4-15(18)16(9-13)27(22,23)20-5-7-24-8-6-20/h3-4,9H,5-8,10H2,1-2H3