(5S,7R)-3-(4-methylphenyl)adamantan-1-ol

Systemtic Name: (5S,7R)-3-(4-methylphenyl)adamantan-1-ol Openeye Name: (5S,7R)-3-(p-tolyl)adamantan-1-ol CAS Name: (5S,7R)-3-(4-methylphenyl)-1-adamantanol IUPAC Name: (5S,7R)-3-(4-methylphenyl)adamantan-1-ol Traditional Name: (5S,7R)-3-(p-tolyl)adamantan-1-ol Formula: C17H22O MolecularWeight: 242.35598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CC1=CC=C(C=C1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C17H22O/c1-12-2-4-15(5-3-12)16-7-13-6-14(8-16)10-17(18,9-13)11-16/h2-5,13-14,18H,6-11H2,1H3/t13-,14+,16?,17?