N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]adamantane-1-carboxamide

Systemtic Name: N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]adamantane-1-carboxamide Openeye Name: N-[4-[4-(1,1-dimethylpropyl)phenoxy]phenyl]adamantane-1-carboxamide CAS Name: N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]-1-adamantanecarboxamide IUPAC Name: N-[4-[4-(2-methylbutan-2-yl)phenoxy]phenyl]adamantane-1-carboxamide Traditional Name: N-[4-(4-tert-amylphenoxy)phenyl]adamantane-1-carboxamide Formula: C28H35NO2 MolecularWeight: 417.583

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H35NO2/c1-4-27(2,3)22-5-9-24(10-6-22)31-25-11-7-23(8-12-25)29-26(30)28-16-19-13-20(17-28)15-21(14-19)18-28/h5-12,19-21H,4,13-18H2,1-3H3,(H,29,30)