methyl [3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanesulfonate

Systemtic Name: methyl [3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanesulfonate Openeye Name: methyl [3-(4-cyanophenyl)-4,5-dihydroisoxazol-5-yl]methanesulfonate CAS Name: [3-(4-cyanophenyl)-4,5-dihydroisoxazol-5-yl]methanesulfonic acid methyl ester IUPAC Name: methyl [3-(4-cyanophenyl)-4,5-dihydro-1,2-oxazol-5-yl]methanesulfonate Traditional Name: [3-(4-cyanophenyl)-2-isoxazolin-5-yl]methanesulfonic acid methyl ester Formula: C12H12N2O4S MolecularWeight: 280.29968

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)CC1CC(=NO1)C2=CC=C(C=C2)C#N

Isomeric SMILES

COS(=O)(=O)CC1CC(=NO1)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C12H12N2O4S/c1-17-19(15,16)8-11-6-12(14-18-11)10-4-2-9(7-13)3-5-10/h2-5,11H,6,8H2,1H3