N-[(4-dimethylaminophenyl)methyl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Traditional Name: N-[4-(dimethylamino)benzyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]acetamide Formula: C21H30N2O2 MolecularWeight: 342.4751

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)CC23CC4CC(C2)CC(C4)(C3)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)CC23C[C@H]4C[C@@H](C2)CC(C4)(C3)O

InChI

InChI=1S/C21H30N2O2/c1-23(2)18-5-3-15(4-6-18)13-22-19(24)12-20-8-16-7-17(9-20)11-21(25,10-16)14-20/h3-6,16-17,25H,7-14H2,1-2H3,(H,22,24)/t16-,17+,20?,21?