[4-imidazol-1-yl-1-(4-methoxyphenyl)butan-2-yl] methanesulfonate

Systemtic Name: [4-imidazol-1-yl-1-(4-methoxyphenyl)butan-2-yl] methanesulfonate Openeye Name: [3-imidazol-1-yl-1-[(4-methoxyphenyl)methyl]propyl] methanesulfonate CAS Name: methanesulfonic acid [4-(1-imidazolyl)-1-(4-methoxyphenyl)butan-2-yl] ester IUPAC Name: [4-imidazol-1-yl-1-(4-methoxyphenyl)butan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid (3-imidazol-1-yl-1-p-anisyl-propyl) ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(CCN2C=CN=C2)OS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)CC(CCN2C=CN=C2)OS(=O)(=O)C

InChI

InChI=1S/C15H20N2O4S/c1-20-14-5-3-13(4-6-14)11-15(21-22(2,18)19)7-9-17-10-8-16-12-17/h3-6,8,10,12,15H,7,9,11H2,1-2H3