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

Systemtic Name: N-[(5S,7R)-3-[4-(2-methoxyphenyl)piperazin-1-yl]carbonyl-1-adamantyl]ethanamide Openeye Name: N-[(5S,7R)-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-adamantyl]acetamide CAS Name: N-[(5S,7R)-3-[[4-(2-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1-adamantyl]acetamide IUPAC Name: N-[(5S,7R)-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-adamantyl]acetamide Traditional Name: N-[(5S,7R)-3-[4-(2-methoxyphenyl)piperazine-1-carbonyl]-1-adamantyl]acetamide Formula: C24H33N3O3 MolecularWeight: 411.53712

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC(=O)NC12C[C@@H]3C[C@H](C1)CC(C3)(C2)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C24H33N3O3/c1-17(28)25-24-14-18-11-19(15-24)13-23(12-18,16-24)22(29)27-9-7-26(8-10-27)20-5-3-4-6-21(20)30-2/h3-6,18-19H,7-16H2,1-2H3,(H,25,28)/t18-,19+,23?,24?