methanesulfonic acid; 8-methoxy-1-methyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole

Systemtic Name: methanesulfonic acid; 8-methoxy-1-methyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole Openeye Name: methanesulfonic acid; 8-methoxy-1-methyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole CAS Name: methanesulfonic acid; 8-methoxy-1-methyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole IUPAC Name: methanesulfonic acid; 8-methoxy-1-methyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole Traditional Name: mesylic acid; 8-methoxy-1-methyl-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCN2C1=NC3=C2C=CC(=C3)OC.CS(=O)(=O)O

Isomeric SMILES

CN1CCCN2C1=NC3=C2C=CC(=C3)OC.CS(=O)(=O)O

InChI

InChI=1S/C12H15N3O.CH4O3S/c1-14-6-3-7-15-11-5-4-9(16-2)8-10(11)13-12(14)15;1-5(2,3)4/h4-5,8H,3,6-7H2,1-2H3;1H3,(H,2,3,4)