3-methylsulfonyl-2-oxidanidyl-5-[(E)-2-phenylethenyl]-4,5-dihydro-1,2-oxazol-2-ium

Systemtic Name: 3-methylsulfonyl-2-oxidanidyl-5-[(E)-2-phenylethenyl]-4,5-dihydro-1,2-oxazol-2-ium Openeye Name: 3-methylsulfonyl-2-oxido-5-[(E)-styryl]-4,5-dihydroisoxazol-2-ium CAS Name: 3-methylsulfonyl-2-oxido-5-[(E)-2-phenylethenyl]-4,5-dihydroisoxazol-2-ium IUPAC Name: 3-methylsulfonyl-2-oxido-5-[(E)-2-phenylethenyl]-4,5-dihydro-1,2-oxazol-2-ium Traditional Name: 3-mesyl-2-oxido-5-[(E)-styryl]-2-isoxazolin-2-ium Formula: C12H13NO4S MolecularWeight: 267.30092

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=[N+](OC(C1)C=CC2=CC=CC=C2)[O-]

Isomeric SMILES

CS(=O)(=O)C1=[N+](OC(C1)/C=C/C2=CC=CC=C2)[O-]

InChI

InChI=1S/C12H13NO4S/c1-18(15,16)12-9-11(17-13(12)14)8-7-10-5-3-2-4-6-10/h2-8,11H,9H2,1H3/b8-7+