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

Systemtic Name: [3-(4-pyridin-4-ylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl methanesulfonate Openeye Name: [3-[4-(4-pyridyl)phenyl]-4,5-dihydroisoxazol-5-yl]methyl methanesulfonate CAS Name: methanesulfonic acid [3-(4-pyridin-4-ylphenyl)-4,5-dihydroisoxazol-5-yl]methyl ester IUPAC Name: [3-(4-pyridin-4-ylphenyl)-4,5-dihydro-1,2-oxazol-5-yl]methyl methanesulfonate Traditional Name: methanesulfonic acid [3-[4-(4-pyridyl)phenyl]-2-isoxazolin-5-yl]methyl ester Formula: C16H16N2O4S MolecularWeight: 332.37424

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1CC(=NO1)C2=CC=C(C=C2)C3=CC=NC=C3

Isomeric SMILES

CS(=O)(=O)OCC1CC(=NO1)C2=CC=C(C=C2)C3=CC=NC=C3

InChI

InChI=1S/C16H16N2O4S/c1-23(19,20)21-11-15-10-16(18-22-15)14-4-2-12(3-5-14)13-6-8-17-9-7-13/h2-9,15H,10-11H2,1H3