[(2R)-3-[4-(1-adamantyl)phenoxy]-2-oxidanyl-propyl]-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-oxidanyl-propyl]-propan-2-yl-azanium Openeye Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxy-propyl]-isopropyl-ammonium CAS Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxypropyl]-propan-2-ylammonium IUPAC Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxypropyl]-propan-2-ylazanium Traditional Name: [(2R)-3-[4-(1-adamantyl)phenoxy]-2-hydroxy-propyl]-isopropyl-ammonium Formula: C22H34NO2+ MolecularWeight: 344.51086

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H33NO2/c1-15(2)23-13-20(24)14-25-21-5-3-19(4-6-21)22-10-16-7-17(11-22)9-18(8-16)12-22/h3-6,15-18,20,23-24H,7-14H2,1-2H3/p+1/t16?,17?,18?,20-,22?/m1/s1