[4-(4-acetamidophenoxy)-4-oxidanylidene-butyl]-[[2-[(R)-cyclohexyl-oxidanyl-phenyl-methyl]-1,3-oxazol-5-yl]methyl]-dimethyl-azanium

Systemtic Name: [4-(4-acetamidophenoxy)-4-oxidanylidene-butyl]-[[2-[(R)-cyclohexyl-oxidanyl-phenyl-methyl]-1,3-oxazol-5-yl]methyl]-dimethyl-azanium Openeye Name: [4-(4-acetamidophenoxy)-4-oxo-butyl]-[[2-[(R)-cyclohexyl-hydroxy-phenyl-methyl]oxazol-5-yl]methyl]-dimethyl-ammonium CAS Name: [4-(4-acetamidophenoxy)-4-oxobutyl]-[[2-[(R)-cyclohexyl-hydroxy-phenylmethyl]-5-oxazolyl]methyl]-dimethylammonium IUPAC Name: [4-(4-acetamidophenoxy)-4-oxobutyl]-[[2-[(R)-cyclohexyl-hydroxy-phenylmethyl]-1,3-oxazol-5-yl]methyl]-dimethylazanium Traditional Name: [4-(4-acetamidophenoxy)-4-keto-butyl]-[[2-[(R)-cyclohexyl-hydroxy-phenyl-methyl]oxazol-5-yl]methyl]-dimethyl-ammonium Formula: C31H40N3O5+ MolecularWeight: 534.6664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)CCC[N+](C)(C)CC2=CN=C(O2)C(C3CCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)CCC[N+](C)(C)CC2=CN=C(O2)[C@@](C3CCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C31H39N3O5/c1-23(35)33-26-16-18-27(19-17-26)38-29(36)15-10-20-34(2,3)22-28-21-32-30(39-28)31(37,24-11-6-4-7-12-24)25-13-8-5-9-14-25/h4,6-7,11-12,16-19,21,25,37H,5,8-10,13-15,20,22H2,1-3H3/p+1/t31-/m0/s1