[(2R)-3-(4-tert-butyl-2-methyl-phenoxy)-2-oxidanyl-propyl]-ethyl-(2-hydroxyethyl)azanium

Systemtic Name: [(2R)-3-(4-tert-butyl-2-methyl-phenoxy)-2-oxidanyl-propyl]-ethyl-(2-hydroxyethyl)azanium Openeye Name: [(2R)-3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]-ethyl-(2-hydroxyethyl)ammonium CAS Name: [(2R)-3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]-ethyl-(2-hydroxyethyl)ammonium IUPAC Name: [(2R)-3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]-ethyl-(2-hydroxyethyl)azanium Traditional Name: [(2R)-3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]-ethyl-(2-hydroxyethyl)ammonium Formula: C18H32NO3+ MolecularWeight: 310.45158

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCO)CC(COC1=C(C=C(C=C1)C(C)(C)C)C)O

Isomeric SMILES

CC[NH+](CCO)C[C@H](COC1=C(C=C(C=C1)C(C)(C)C)C)O

InChI

InChI=1S/C18H31NO3/c1-6-19(9-10-20)12-16(21)13-22-17-8-7-15(11-14(17)2)18(3,4)5/h7-8,11,16,20-21H,6,9-10,12-13H2,1-5H3/p+1/t16-/m1/s1