methanesulfonate; 4-(4-methylmorpholin-4-ium-4-yl)benzaldehyde

Systemtic Name: methanesulfonate; 4-(4-methylmorpholin-4-ium-4-yl)benzaldehyde Openeye Name: methanesulfonate; 4-(4-methylmorpholin-4-ium-4-yl)benzaldehyde CAS Name: methanesulfonate; 4-(4-methyl-4-morpholin-4-iumyl)benzaldehyde IUPAC Name: methanesulfonate; 4-(4-methylmorpholin-4-ium-4-yl)benzaldehyde Traditional Name: 4-(4-methylmorpholin-4-ium-4-yl)benzaldehyde mesylate Formula: C13H19NO5S MolecularWeight: 301.35866

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCOCC1)C2=CC=C(C=C2)C=O.CS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1(CCOCC1)C2=CC=C(C=C2)C=O.CS(=O)(=O)[O-]

InChI

InChI=1S/C12H16NO2.CH4O3S/c1-13(6-8-15-9-7-13)12-4-2-11(10-14)3-5-12;1-5(2,3)4/h2-5,10H,6-9H2,1H3;1H3,(H,2,3,4)/q+1;/p-1