methanesulfonate; 1-methyl-1,10-phenanthrolin-1-ium

Systemtic Name: methanesulfonate; 1-methyl-1,10-phenanthrolin-1-ium Openeye Name: methanesulfonate; 1-methyl-1,10-phenanthrolin-1-ium CAS Name: methanesulfonate; 1-methyl-1,10-phenanthrolin-1-ium IUPAC Name: methanesulfonate; 1-methyl-1,10-phenanthrolin-1-ium Traditional Name: 1-methyl-1,10-phenanthrolin-1-ium mesylate Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC2=C1C3=C(C=CC=N3)C=C2.CS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=CC2=C1C3=C(C=CC=N3)C=C2.CS(=O)(=O)[O-]

InChI

InChI=1S/C13H11N2.CH4O3S/c1-15-9-3-5-11-7-6-10-4-2-8-14-12(10)13(11)15;1-5(2,3)4/h2-9H,1H3;1H3,(H,2,3,4)/q+1;/p-1