2-[4-(1-adamantylcarbonyl)piperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide

Systemtic Name: 2-[4-(1-adamantylcarbonyl)piperazin-1-yl]-N-(2,3-dimethylphenyl)ethanamide Openeye Name: 2-[4-(adamantane-1-carbonyl)piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide CAS Name: 2-[4-[1-adamantyl(oxo)methyl]-1-piperazinyl]-N-(2,3-dimethylphenyl)acetamide IUPAC Name: 2-[4-(adamantane-1-carbonyl)piperazin-1-yl]-N-(2,3-dimethylphenyl)acetamide Traditional Name: 2-[4-(adamantane-1-carbonyl)piperazino]-N-(2,3-dimethylphenyl)acetamide Formula: C25H35N3O2 MolecularWeight: 409.5643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)C

InChI

InChI=1S/C25H35N3O2/c1-17-4-3-5-22(18(17)2)26-23(29)16-27-6-8-28(9-7-27)24(30)25-13-19-10-20(14-25)12-21(11-19)15-25/h3-5,19-21H,6-16H2,1-2H3,(H,26,29)