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

Systemtic Name: [2-(cycloheptyl-oxidanyl-phenyl-methyl)-1,3-oxazol-5-yl]methyl-dimethyl-(2-phenethyloxyethyl)azanium Openeye Name: [2-(cycloheptyl-hydroxy-phenyl-methyl)oxazol-5-yl]methyl-dimethyl-(2-phenethyloxyethyl)ammonium CAS Name: [2-(cycloheptyl-hydroxy-phenylmethyl)-5-oxazolyl]methyl-dimethyl-(2-phenethyloxyethyl)ammonium IUPAC Name: [2-(cycloheptyl-hydroxy-phenylmethyl)-1,3-oxazol-5-yl]methyl-dimethyl-(2-phenethyloxyethyl)azanium Traditional Name: [2-(cycloheptyl-hydroxy-phenyl-methyl)oxazol-5-yl]methyl-dimethyl-(2-phenethyloxyethyl)ammonium Formula: C30H41N2O3+ MolecularWeight: 477.65814

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCOCCC1=CC=CC=C1)CC2=CN=C(O2)C(C3CCCCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

C[N+](C)(CCOCCC1=CC=CC=C1)CC2=CN=C(O2)C(C3CCCCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C30H41N2O3/c1-32(2,20-22-34-21-19-25-13-7-5-8-14-25)24-28-23-31-29(35-28)30(33,27-17-11-6-12-18-27)26-15-9-3-4-10-16-26/h5-8,11-14,17-18,23,26,33H,3-4,9-10,15-16,19-22,24H2,1-2H3/q+1