1-adamantyl-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: 1-adamantyl-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: 1-adamantyl-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: 1-adamantyl-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: 1-adamantyl-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: 1-adamantyl-[4-(3-fluoro-4-methoxy-benzyl)piperazino]methanone Formula: C23H31FN2O2 MolecularWeight: 386.502843

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C(=O)C34CC5CC(C3)CC(C5)C4)F

InChI

InChI=1S/C23H31FN2O2/c1-28-21-3-2-16(11-20(21)24)15-25-4-6-26(7-5-25)22(27)23-12-17-8-18(13-23)10-19(9-17)14-23/h2-3,11,17-19H,4-10,12-15H2,1H3