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

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

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC1CC(=NO1)C2=CC=C(C=C2)[N+]#[C-]

Isomeric SMILES

CS(=O)(=O)OCC1CC(=NO1)C2=CC=C(C=C2)[N+]#[C-]

InChI

InChI=1S/C12H12N2O4S/c1-13-10-5-3-9(4-6-10)12-7-11(18-14-12)8-17-19(2,15)16/h3-6,11H,7-8H2,2H3