(5S,7R)-N-(4-ethanoylphenyl)-3-(4-methylphenyl)adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-(4-ethanoylphenyl)-3-(4-methylphenyl)adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(4-acetylphenyl)-3-(p-tolyl)adamantane-1-carboxamide CAS Name: (5S,7R)-N-(4-acetylphenyl)-3-(4-methylphenyl)-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-(4-acetylphenyl)-3-(4-methylphenyl)adamantane-1-carboxamide Traditional Name: (5S,7R)-N-(4-acetylphenyl)-3-(p-tolyl)adamantane-1-carboxamide Formula: C26H29NO2 MolecularWeight: 387.51396

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)C(=O)NC5=CC=C(C=C5)C(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)C(=O)NC5=CC=C(C=C5)C(=O)C

InChI

InChI=1S/C26H29NO2/c1-17-3-7-22(8-4-17)25-12-19-11-20(13-25)15-26(14-19,16-25)24(29)27-23-9-5-21(6-10-23)18(2)28/h3-10,19-20H,11-16H2,1-2H3,(H,27,29)/t19-,20+,25?,26?