[(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-oxidanyl-propyl]-pentan-3-yl-azanium

Systemtic Name: [(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-oxidanyl-propyl]-pentan-3-yl-azanium Openeye Name: [(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-hydroxy-propyl]-(1-ethylpropyl)ammonium CAS Name: [(2R)-3-(2-tert-butyl-4-methoxyphenoxy)-2-hydroxypropyl]-pentan-3-ylammonium IUPAC Name: [(2R)-3-(2-tert-butyl-4-methoxyphenoxy)-2-hydroxypropyl]-pentan-3-ylazanium Traditional Name: [(2R)-3-(2-tert-butyl-4-methoxy-phenoxy)-2-hydroxy-propyl]-(1-ethylpropyl)ammonium Formula: C19H34NO3+ MolecularWeight: 324.47816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)[NH2+]CC(COC1=C(C=C(C=C1)OC)C(C)(C)C)O

Isomeric SMILES

CCC(CC)[NH2+]C[C@H](COC1=C(C=C(C=C1)OC)C(C)(C)C)O

InChI

InChI=1S/C19H33NO3/c1-7-14(8-2)20-12-15(21)13-23-18-10-9-16(22-6)11-17(18)19(3,4)5/h9-11,14-15,20-21H,7-8,12-13H2,1-6H3/p+1/t15-/m1/s1