(5S,7R)-N-(1-adamantyl)-3-phenyl-adamantane-1-carboxamide

Systemtic Name: (5S,7R)-N-(1-adamantyl)-3-phenyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(1-adamantyl)-3-phenyl-adamantane-1-carboxamide CAS Name: (5S,7R)-N-(1-adamantyl)-3-phenyl-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-(1-adamantyl)-3-phenyladamantane-1-carboxamide Traditional Name: (5S,7R)-N-(1-adamantyl)-3-phenyl-adamantane-1-carboxamide Formula: C27H35NO MolecularWeight: 389.5729

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC(=O)C45CC6CC(C4)CC(C6)(C5)C7=CC=CC=C7

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)C(=O)NC45CC6CC(C4)CC(C6)C5)C7=CC=CC=C7

InChI

InChI=1S/C27H35NO/c29-24(28-27-14-18-6-19(15-27)8-20(7-18)16-27)26-12-21-9-22(13-26)11-25(10-21,17-26)23-4-2-1-3-5-23/h1-5,18-22H,6-17H2,(H,28,29)/t18?,19?,20?,21-,22+,25?,26?,27?