[(2R)-2-oxidanyl-3-(4-propan-2-ylphenoxy)propyl]-(2,4,4-trimethylpentan-2-yl)azanium

Systemtic Name: [(2R)-2-oxidanyl-3-(4-propan-2-ylphenoxy)propyl]-(2,4,4-trimethylpentan-2-yl)azanium Openeye Name: [(2R)-2-hydroxy-3-(4-isopropylphenoxy)propyl]-(1,1,3,3-tetramethylbutyl)ammonium CAS Name: [(2R)-2-hydroxy-3-(4-propan-2-ylphenoxy)propyl]-(2,4,4-trimethylpentan-2-yl)ammonium IUPAC Name: [(2R)-2-hydroxy-3-(4-propan-2-ylphenoxy)propyl]-(2,4,4-trimethylpentan-2-yl)azanium Traditional Name: [(2R)-2-hydroxy-3-(4-isopropylphenoxy)propyl]-(1,1,3,3-tetramethylbutyl)ammonium Formula: C20H36NO2+ MolecularWeight: 322.50534

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC(C[NH2+]C(C)(C)CC(C)(C)C)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC[C@@H](C[NH2+]C(C)(C)CC(C)(C)C)O

InChI

InChI=1S/C20H35NO2/c1-15(2)16-8-10-18(11-9-16)23-13-17(22)12-21-20(6,7)14-19(3,4)5/h8-11,15,17,21-22H,12-14H2,1-7H3/p+1/t17-/m1/s1