(5S,7R)-3-(4-methylphenyl)-N-(3-propan-2-yloxypropyl)adamantane-1-carboxamide

Systemtic Name: (5S,7R)-3-(4-methylphenyl)-N-(3-propan-2-yloxypropyl)adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(3-isopropoxypropyl)-3-(p-tolyl)adamantane-1-carboxamide CAS Name: (5S,7R)-3-(4-methylphenyl)-N-(3-propan-2-yloxypropyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-3-(4-methylphenyl)-N-(3-propan-2-yloxypropyl)adamantane-1-carboxamide Traditional Name: (5S,7R)-N-(3-isopropoxypropyl)-3-(p-tolyl)adamantane-1-carboxamide Formula: C24H35NO2 MolecularWeight: 369.5402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H35NO2/c1-17(2)27-10-4-9-25-22(26)24-14-19-11-20(15-24)13-23(12-19,16-24)21-7-5-18(3)6-8-21/h5-8,17,19-20H,4,9-16H2,1-3H3,(H,25,26)/t19-,20+,23?,24?