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

Systemtic Name: (5S,7R)-N-(3-ethanoylphenyl)-3-oxidanyl-adamantane-1-carboxamide Openeye Name: (5S,7R)-N-(3-acetylphenyl)-3-hydroxy-adamantane-1-carboxamide CAS Name: (5S,7R)-N-(3-acetylphenyl)-3-hydroxy-1-adamantanecarboxamide IUPAC Name: (5S,7R)-N-(3-acetylphenyl)-3-hydroxyadamantane-1-carboxamide Traditional Name: (5S,7R)-N-(3-acetylphenyl)-3-hydroxy-adamantane-1-carboxamide Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO3/c1-12(21)15-3-2-4-16(6-15)20-17(22)18-7-13-5-14(8-18)10-19(23,9-13)11-18/h2-4,6,13-14,23H,5,7-11H2,1H3,(H,20,22)/t13-,14+,18?,19?