[(2R)-3-[4-(1-adamantyl)phenoxy]-2-oxidanyl-propyl]-tert-butyl-azanium

Systemtic Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-oxidanyl-propyl]-tert-butyl-azanium Openeye Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxy-propyl]-tert-butyl-ammonium CAS Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxypropyl]-tert-butylammonium IUPAC Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxypropyl]-tert-butylazanium Traditional Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxy-propyl]-tert-butyl-ammonium Formula: C23H36NO2+ MolecularWeight: 358.53744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)O

Isomeric SMILES

CC(C)(C)[NH2+]C[C@H](COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)O

InChI

InChI=1S/C23H35NO2/c1-22(2,3)24-14-20(25)15-26-21-6-4-19(5-7-21)23-11-16-8-17(12-23)10-18(9-16)13-23/h4-7,16-18,20,24-25H,8-15H2,1-3H3/p+1/t16?,17?,18?,20-,23?/m1/s1