1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanone

Systemtic Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-[(5S,7R)-3-oxidanyl-1-adamantyl]ethanone Openeye Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]ethanone CAS Name: 1-[4-(2,3-dimethylphenyl)-1-piperazinyl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]ethanone IUPAC Name: 1-[4-(2,3-dimethylphenyl)piperazin-1-yl]-2-[(5S,7R)-3-hydroxy-1-adamantyl]ethanone Traditional Name: 1-[4-(2,3-dimethylphenyl)piperazino]-2-[(5S,7R)-3-hydroxy-1-adamantyl]ethanone Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)(C4)O)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CC34C[C@H]5C[C@@H](C3)CC(C5)(C4)O)C

InChI

InChI=1S/C24H34N2O2/c1-17-4-3-5-21(18(17)2)25-6-8-26(9-7-25)22(27)15-23-11-19-10-20(12-23)14-24(28,13-19)16-23/h3-5,19-20,28H,6-16H2,1-2H3/t19-,20+,23?,24?