4-(1-adamantylcarbonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide

Systemtic Name: 4-(1-adamantylcarbonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide Openeye Name: 4-(adamantane-1-carbonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide CAS Name: 4-[1-adamantyl(oxo)methyl]-N-[(4-fluorophenyl)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(adamantane-1-carbonyl)-N-[(4-fluorophenyl)methyl]piperazine-1-carboxamide Traditional Name: 4-(adamantane-1-carbonyl)-N-(4-fluorobenzyl)piperazine-1-carboxamide Formula: C23H30FN3O2 MolecularWeight: 399.501603

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NCC5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCN1C(=O)C23CC4CC(C2)CC(C4)C3)C(=O)NCC5=CC=C(C=C5)F

InChI

InChI=1S/C23H30FN3O2/c24-20-3-1-16(2-4-20)15-25-22(29)27-7-5-26(6-8-27)21(28)23-12-17-9-18(13-23)11-19(10-17)14-23/h1-4,17-19H,5-15H2,(H,25,29)