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

Systemtic Name: butyl-[(2R)-3-(4-tert-butyl-2-methyl-phenoxy)-2-oxidanyl-propyl]-ethyl-azanium Openeye Name: butyl-[(2R)-3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]-ethyl-ammonium CAS Name: butyl-[(2R)-3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]-ethylammonium IUPAC Name: butyl-[(2R)-3-(4-tert-butyl-2-methylphenoxy)-2-hydroxypropyl]-ethylazanium Traditional Name: butyl-[(2R)-3-(4-tert-butyl-2-methyl-phenoxy)-2-hydroxy-propyl]-ethyl-ammonium Formula: C20H36NO2+ MolecularWeight: 322.50534

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H35NO2/c1-7-9-12-21(8-2)14-18(22)15-23-19-11-10-17(13-16(19)3)20(4,5)6/h10-11,13,18,22H,7-9,12,14-15H2,1-6H3/p+1/t18-/m1/s1