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

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-methyl-5-morpholin-4-ylsulfonyl-benzoate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 2-methyl-5-morpholinosulfonyl-benzoate CAS Name: 2-methyl-5-(4-morpholinylsulfonyl)benzoic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-methyl-5-morpholin-4-ylsulfonylbenzoate Traditional Name: 2-methyl-5-morpholinosulfonyl-benzoic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C18H22N2O6S MolecularWeight: 394.44208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=C(ON=C3C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)OCC3=C(ON=C3C)C

InChI

InChI=1S/C18H22N2O6S/c1-12-4-5-15(27(22,23)20-6-8-24-9-7-20)10-16(12)18(21)25-11-17-13(2)19-26-14(17)3/h4-5,10H,6-9,11H2,1-3H3