(3-morpholin-4-ylsulfonylphenyl)methyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 5-methyl-3-phenyl-isoxazole-4-carboxylate CAS Name: 5-methyl-3-phenyl-4-isoxazolecarboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate Traditional Name: 5-methyl-3-phenyl-isoxazole-4-carboxylic acid (3-morpholinosulfonylbenzyl) ester Formula: C22H22N2O6S MolecularWeight: 442.48488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)OCC3=CC(=CC=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H22N2O6S/c1-16-20(21(23-30-16)18-7-3-2-4-8-18)22(25)29-15-17-6-5-9-19(14-17)31(26,27)24-10-12-28-13-11-24/h2-9,14H,10-13,15H2,1H3