1-[4-(1-adamantyl)phenoxy]-3-(tert-butylamino)propan-2-ol chloride

Systemtic Name: 1-[4-(1-adamantyl)phenoxy]-3-(tert-butylamino)propan-2-ol chloride Openeye Name: 1-[4-(1-adamantyl)phenoxy]-3-(tert-butylamino)propan-2-ol chloride CAS Name: 1-[4-(1-adamantyl)phenoxy]-3-(tert-butylamino)-2-propanol chloride IUPAC Name: 1-[4-(1-adamantyl)phenoxy]-3-(tert-butylamino)propan-2-ol chloride Traditional Name: 1-[4-(1-adamantyl)phenoxy]-3-(tert-butylamino)propan-2-ol chloride Formula: C23H35ClNO2- MolecularWeight: 392.9825

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)O.[Cl-]

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)C3)O.[Cl-]

InChI

InChI=1S/C23H35NO2.ClH/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;1H/p-1