1-adamantyl-[4-[(4,5-dimethyl-2-oxidanyl-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[(4,5-dimethyl-2-oxidanyl-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[(2-hydroxy-4,5-dimethyl-phenyl)methyl]piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-[(2-hydroxy-4,5-dimethylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-[(2-hydroxy-4,5-dimethylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(2-hydroxy-4,5-dimethyl-benzyl)piperazino]methanone Formula: C24H34N2O2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)O)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CC1=CC(=C(C=C1C)O)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H34N2O2/c1-16-7-21(22(27)8-17(16)2)15-25-3-5-26(6-4-25)23(28)24-12-18-9-19(13-24)11-20(10-18)14-24/h7-8,18-20,27H,3-6,9-15H2,1-2H3