[(1R)-1-(1H-benzimidazol-2-yl)ethyl] 2,4-bis(chloranyl)-5-methyl-benzenesulfonate

Systemtic Name: [(1R)-1-(1H-benzimidazol-2-yl)ethyl] 2,4-bis(chloranyl)-5-methyl-benzenesulfonate Openeye Name: [(1R)-1-(1H-benzimidazol-2-yl)ethyl] 2,4-dichloro-5-methyl-benzenesulfonate CAS Name: 2,4-dichloro-5-methylbenzenesulfonic acid [(1R)-1-(1H-benzimidazol-2-yl)ethyl] ester IUPAC Name: [(1R)-1-(1H-benzimidazol-2-yl)ethyl] 2,4-dichloro-5-methylbenzenesulfonate Traditional Name: 2,4-dichloro-5-methyl-benzenesulfonic acid [(1R)-1-(1H-benzimidazol-2-yl)ethyl] ester Formula: C16H14Cl2N2O3S MolecularWeight: 385.26496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)OC(C)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CC1=CC(=C(C=C1Cl)Cl)S(=O)(=O)O[C@H](C)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H14Cl2N2O3S/c1-9-7-15(12(18)8-11(9)17)24(21,22)23-10(2)16-19-13-5-3-4-6-14(13)20-16/h3-8,10H,1-2H3,(H,19,20)/t10-/m1/s1