N-[4-(azepan-1-yl)phenyl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CC34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CC34C[C@H]5C[C@@H](C3)CC(C5)(C4)O

InChI

InChI=1S/C24H34N2O2/c27-22(16-23-12-18-11-19(13-23)15-24(28,14-18)17-23)25-20-5-7-21(8-6-20)26-9-3-1-2-4-10-26/h5-8,18-19,28H,1-4,9-17H2,(H,25,27)/t18-,19+,23?,24?