(5S,7R)-N-(4-tert-butylphenyl)-3-oxidanyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-(4-tert-butylphenyl)-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(4-tert-butylphenyl)-3-hydroxy-adamantane-1-carboxamide CAS Name: (5S,7R)-N-(4-tert-butylphenyl)-3-hydroxy-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-(4-tert-butylphenyl)-3-hydroxyadamantane-1-carboxamide Traditional Name: (5S,7R)-N-(4-tert-butylphenyl)-3-hydroxy-adamantane-1-carboxamide Formula: C21H29NO2 MolecularWeight: 327.46046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29NO2/c1-19(2,3)16-4-6-17(7-5-16)22-18(23)20-9-14-8-15(10-20)12-21(24,11-14)13-20/h4-7,14-15,24H,8-13H2,1-3H3,(H,22,23)/t14-,15+,20?,21?