2-[[2-[(R)-cyclohexyl-oxidanyl-phenyl-methyl]-1,3-oxazol-5-yl]methyl-dimethyl-azaniumyl]ethyl-(phenylsulfonyl)azanide

Systemtic Name: 2-[[2-[(R)-cyclohexyl-oxidanyl-phenyl-methyl]-1,3-oxazol-5-yl]methyl-dimethyl-azaniumyl]ethyl-(phenylsulfonyl)azanide Openeye Name: benzenesulfonyl-[2-[[2-[(R)-cyclohexyl-hydroxy-phenyl-methyl]oxazol-5-yl]methyl-dimethyl-ammonio]ethyl]azanide CAS Name: benzenesulfonyl-[2-[[2-[(R)-cyclohexyl-hydroxy-phenylmethyl]-5-oxazolyl]methyl-dimethylammonio]ethyl]azanide IUPAC Name: benzenesulfonyl-[2-[[2-[(R)-cyclohexyl-hydroxy-phenylmethyl]-1,3-oxazol-5-yl]methyl-dimethylazaniumyl]ethyl]azanide Traditional Name: besyl-[2-[[2-[(R)-cyclohexyl-hydroxy-phenyl-methyl]oxazol-5-yl]methyl-dimethyl-ammonio]ethyl]azanide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CC[N-]S(=O)(=O)C1=CC=CC=C1)CC2=CN=C(O2)C(C3CCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

C[N+](C)(CC[N-]S(=O)(=O)C1=CC=CC=C1)CC2=CN=C(O2)[C@@](C3CCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C27H35N3O4S/c1-30(2,19-18-29-35(32,33)25-16-10-5-11-17-25)21-24-20-28-26(34-24)27(31,22-12-6-3-7-13-22)23-14-8-4-9-15-23/h3,5-7,10-13,16-17,20,23,31H,4,8-9,14-15,18-19,21H2,1-2H3/t27-/m0/s1