methanesulfonate; 1-[4-(4-methoxyphenyl)butyl]-1,2,3-triazole

Systemtic Name: methanesulfonate; 1-[4-(4-methoxyphenyl)butyl]-1,2,3-triazole Openeye Name: methanesulfonate; 1-[4-(4-methoxyphenyl)butyl]triazole CAS Name: methanesulfonate; 1-[4-(4-methoxyphenyl)butyl]triazole IUPAC Name: methanesulfonate; 1-[4-(4-methoxyphenyl)butyl]triazole Traditional Name: 1-[4-(4-methoxyphenyl)butyl]triazole mesylate Formula: C14H20N3O4S- MolecularWeight: 326.3913

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCCN2C=CN=N2.CS(=O)(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCCCN2C=CN=N2.CS(=O)(=O)[O-]

InChI

InChI=1S/C13H17N3O.CH4O3S/c1-17-13-7-5-12(6-8-13)4-2-3-10-16-11-9-14-15-16;1-5(2,3)4/h5-9,11H,2-4,10H2,1H3;1H3,(H,2,3,4)/p-1