[3-(cyclohexyl-oxidanyl-phenyl-methyl)-1,2-oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)azanium

Systemtic Name: [3-(cyclohexyl-oxidanyl-phenyl-methyl)-1,2-oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)azanium Openeye Name: [3-(cyclohexyl-hydroxy-phenyl-methyl)isoxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)ammonium CAS Name: [3-(cyclohexyl-hydroxy-phenylmethyl)-5-isoxazolyl]methyl-dimethyl-(3-phenoxypropyl)ammonium IUPAC Name: [3-(cyclohexyl-hydroxy-phenylmethyl)-1,2-oxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)azanium Traditional Name: [3-(cyclohexyl-hydroxy-phenyl-methyl)isoxazol-5-yl]methyl-dimethyl-(3-phenoxypropyl)ammonium Formula: C28H37N2O3+ MolecularWeight: 449.60498

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCOC1=CC=CC=C1)CC2=CC(=NO2)C(C3CCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

C[N+](C)(CCCOC1=CC=CC=C1)CC2=CC(=NO2)C(C3CCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C28H37N2O3/c1-30(2,19-12-20-32-25-17-10-5-11-18-25)22-26-21-27(29-33-26)28(31,23-13-6-3-7-14-23)24-15-8-4-9-16-24/h3,5-7,10-11,13-14,17-18,21,24,31H,4,8-9,12,15-16,19-20,22H2,1-2H3/q+1