1-[4-(1-adamantyl)phenoxy]-3-[2-(4-methylphenyl)ethylamino]propan-2-ol

Systemtic Name: 1-[4-(1-adamantyl)phenoxy]-3-[2-(4-methylphenyl)ethylamino]propan-2-ol Openeye Name: 1-[4-(1-adamantyl)phenoxy]-3-[2-(p-tolyl)ethylamino]propan-2-ol CAS Name: 1-[4-(1-adamantyl)phenoxy]-3-[2-(4-methylphenyl)ethylamino]-2-propanol IUPAC Name: 1-[4-(1-adamantyl)phenoxy]-3-[2-(4-methylphenyl)ethylamino]propan-2-ol Traditional Name: 1-[4-(1-adamantyl)phenoxy]-3-[2-(p-tolyl)ethylamino]propan-2-ol Formula: C28H37NO2 MolecularWeight: 419.59888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCNCC(COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

Isomeric SMILES

CC1=CC=C(C=C1)CCNCC(COC2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4)O

InChI

InChI=1S/C28H37NO2/c1-20-2-4-21(5-3-20)10-11-29-18-26(30)19-31-27-8-6-25(7-9-27)28-15-22-12-23(16-28)14-24(13-22)17-28/h2-9,22-24,26,29-30H,10-19H2,1H3