[1-(4-chlorophenyl)-6-imidazol-1-yl-hexan-3-yl] methanesulfonate

Systemtic Name: [1-(4-chlorophenyl)-6-imidazol-1-yl-hexan-3-yl] methanesulfonate Openeye Name: [1-[2-(4-chlorophenyl)ethyl]-4-imidazol-1-yl-butyl] methanesulfonate CAS Name: methanesulfonic acid [1-(4-chlorophenyl)-6-(1-imidazolyl)hexan-3-yl] ester IUPAC Name: [1-(4-chlorophenyl)-6-imidazol-1-ylhexan-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [1-[2-(4-chlorophenyl)ethyl]-4-imidazol-1-yl-butyl] ester Formula: C16H21ClN2O3S MolecularWeight: 356.86754

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CCCN1C=CN=C1)CCC2=CC=C(C=C2)Cl

Isomeric SMILES

CS(=O)(=O)OC(CCCN1C=CN=C1)CCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H21ClN2O3S/c1-23(20,21)22-16(3-2-11-19-12-10-18-13-19)9-6-14-4-7-15(17)8-5-14/h4-5,7-8,10,12-13,16H,2-3,6,9,11H2,1H3