2-(3-oxidanyl-1-adamantyl)-1-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]ethanone

Systemtic Name: 2-(3-oxidanyl-1-adamantyl)-1-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]ethanone Openeye Name: 2-(3-hydroxy-1-adamantyl)-1-[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]ethanone CAS Name: 2-(3-hydroxy-1-adamantyl)-1-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-(3-hydroxy-1-adamantyl)-1-[4-[(4-propan-2-ylphenyl)methyl]piperazin-1-yl]ethanone Traditional Name: 2-(3-hydroxy-1-adamantyl)-1-[4-(4-isopropylbenzyl)piperazino]ethanone Formula: C26H38N2O2 MolecularWeight: 410.59212

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)(C4)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2CCN(CC2)C(=O)CC34CC5CC(C3)CC(C5)(C4)O

InChI

InChI=1S/C26H38N2O2/c1-19(2)23-5-3-20(4-6-23)17-27-7-9-28(10-8-27)24(29)16-25-12-21-11-22(13-25)15-26(30,14-21)18-25/h3-6,19,21-22,30H,7-18H2,1-2H3