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

Systemtic Name: 1-[4-(1-adamantyl)phenoxy]-3-[(3-methylphenyl)amino]propan-2-ol Openeye Name: 1-[4-(1-adamantyl)phenoxy]-3-(3-methylanilino)propan-2-ol CAS Name: 1-[4-(1-adamantyl)phenoxy]-3-(3-methylanilino)-2-propanol IUPAC Name: 1-[4-(1-adamantyl)phenoxy]-3-(3-methylanilino)propan-2-ol Traditional Name: 1-[4-(1-adamantyl)phenoxy]-3-(m-toluidino)propan-2-ol Formula: C26H33NO2 MolecularWeight: 391.54572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33NO2/c1-18-3-2-4-23(9-18)27-16-24(28)17-29-25-7-5-22(6-8-25)26-13-19-10-20(14-26)12-21(11-19)15-26/h2-9,19-21,24,27-28H,10-17H2,1H3