[1-(4-chlorophenyl)-3-imidazol-1-yl-propan-2-yl] methanesulfonate

Systemtic Name: [1-(4-chlorophenyl)-3-imidazol-1-yl-propan-2-yl] methanesulfonate Openeye Name: [1-[(4-chlorophenyl)methyl]-2-imidazol-1-yl-ethyl] methanesulfonate CAS Name: methanesulfonic acid [1-(4-chlorophenyl)-3-(1-imidazolyl)propan-2-yl] ester IUPAC Name: [1-(4-chlorophenyl)-3-imidazol-1-ylpropan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-(4-chlorobenzyl)-2-imidazol-1-yl-ethyl] ester Formula: C13H15ClN2O3S MolecularWeight: 314.7878

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CC1=CC=C(C=C1)Cl)CN2C=CN=C2

Isomeric SMILES

CS(=O)(=O)OC(CC1=CC=C(C=C1)Cl)CN2C=CN=C2

InChI

InChI=1S/C13H15ClN2O3S/c1-20(17,18)19-13(9-16-7-6-15-10-16)8-11-2-4-12(14)5-3-11/h2-7,10,13H,8-9H2,1H3