N-[(5S,7R)-3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-1-adamantyl]ethanamide

Systemtic Name: N-[(5S,7R)-3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-1-adamantyl]ethanamide Openeye Name: N-[(5S,7R)-3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-adamantyl]acetamide CAS Name: N-[(5S,7R)-3-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1-adamantyl]acetamide IUPAC Name: N-[(5S,7R)-3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-adamantyl]acetamide Traditional Name: N-[(5S,7R)-3-[4-(2-furoyl)piperazine-1-carbonyl]-1-adamantyl]acetamide Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)N4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)N4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C22H29N3O4/c1-15(26)23-22-12-16-9-17(13-22)11-21(10-16,14-22)20(28)25-6-4-24(5-7-25)19(27)18-3-2-8-29-18/h2-3,8,16-17H,4-7,9-14H2,1H3,(H,23,26)/t16-,17+,21?,22?