(1-methylimidazol-1-ium-1-yl)methyl 9-methylxanthene-9-carboxylate chloride

Systemtic Name: (1-methylimidazol-1-ium-1-yl)methyl 9-methylxanthene-9-carboxylate chloride Openeye Name: (1-methylimidazol-1-ium-1-yl)methyl 9-methylxanthene-9-carboxylate chloride CAS Name: 9-methyl-9-xanthenecarboxylic acid (1-methyl-1-imidazol-1-iumyl)methyl ester chloride IUPAC Name: (1-methylimidazol-1-ium-1-yl)methyl 9-methylxanthene-9-carboxylate chloride Traditional Name: 9-methylxanthene-9-carboxylic acid (1-methylimidazol-1-ium-1-yl)methyl ester chloride Formula: C20H19ClN2O3 MolecularWeight: 370.82946

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2OC3=CC=CC=C31)C(=O)OC[N+]4(C=CN=C4)C.[Cl-]

Isomeric SMILES

CC1(C2=CC=CC=C2OC3=CC=CC=C31)C(=O)OC[N+]4(C=CN=C4)C.[Cl-]

InChI

InChI=1S/C20H19N2O3.ClH/c1-20(19(23)24-14-22(2)12-11-21-13-22)15-7-3-5-9-17(15)25-18-10-6-4-8-16(18)20;/h3-13H,14H2,1-2H3;1H/q+1;/p-1