methanesulfonate; 9-phenylmethoxy-3,4-dihydro-2H-pyrido[2,1-b][1,3]oxazin-5-ium

Systemtic Name: methanesulfonate; 9-phenylmethoxy-3,4-dihydro-2H-pyrido[2,1-b][1,3]oxazin-5-ium Openeye Name: 9-benzyloxy-3,4-dihydro-2H-pyrido[2,1-b][1,3]oxazin-5-ium; methanesulfonate CAS Name: methanesulfonate; 9-phenylmethoxy-3,4-dihydro-2H-pyrido[2,1-b][1,3]oxazin-5-ium IUPAC Name: methanesulfonate; 9-phenylmethoxy-3,4-dihydro-2H-pyrido[2,1-b][1,3]oxazin-5-ium Traditional Name: 9-benzoxy-3,4-dihydro-2H-pyrido[2,1-b][1,3]oxazin-5-ium mesylate Formula: C16H19NO5S MolecularWeight: 337.39076

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)[O-].C1C[N+]2=CC=CC(=C2OC1)OCC3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)[O-].C1C[N+]2=CC=CC(=C2OC1)OCC3=CC=CC=C3

InChI

InChI=1S/C15H16NO2.CH4O3S/c1-2-6-13(7-3-1)12-18-14-8-4-9-16-10-5-11-17-15(14)16;1-5(2,3)4/h1-4,6-9H,5,10-12H2;1H3,(H,2,3,4)/q+1;/p-1