N-[3-[4-(4-ethanoylphenyl)piperazin-1-yl]carbonyl-1-adamantyl]ethanamide

Systemtic Name: N-[3-[4-(4-ethanoylphenyl)piperazin-1-yl]carbonyl-1-adamantyl]ethanamide Openeye Name: N-[3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-adamantyl]acetamide CAS Name: N-[3-[[4-(4-acetylphenyl)-1-piperazinyl]-oxomethyl]-1-adamantyl]acetamide IUPAC Name: N-[3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-adamantyl]acetamide Traditional Name: N-[3-[4-(4-acetylphenyl)piperazine-1-carbonyl]-1-adamantyl]acetamide Formula: C25H33N3O3 MolecularWeight: 423.54782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

InChI

InChI=1S/C25H33N3O3/c1-17(29)21-3-5-22(6-4-21)27-7-9-28(10-8-27)23(31)24-12-19-11-20(13-24)15-25(14-19,16-24)26-18(2)30/h3-6,19-20H,7-16H2,1-2H3,(H,26,30)