N-[(5S,7R)-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1-adamantyl]ethanamide

Systemtic Name: N-[(5S,7R)-3-[4-(phenylmethyl)piperazin-1-yl]carbonyl-1-adamantyl]ethanamide Openeye Name: N-[(5S,7R)-3-(4-benzylpiperazine-1-carbonyl)-1-adamantyl]acetamide CAS Name: N-[(5S,7R)-3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-1-adamantyl]acetamide IUPAC Name: N-[(5S,7R)-3-(4-benzylpiperazine-1-carbonyl)-1-adamantyl]acetamide Traditional Name: N-[(5S,7R)-3-(4-benzylpiperazine-1-carbonyl)-1-adamantyl]acetamide Formula: C24H33N3O2 MolecularWeight: 395.53772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C24H33N3O2/c1-18(28)25-24-14-20-11-21(15-24)13-23(12-20,17-24)22(29)27-9-7-26(8-10-27)16-19-5-3-2-4-6-19/h2-6,20-21H,7-17H2,1H3,(H,25,28)/t20-,21+,23?,24?