N-(1-adamantylmethyl)-2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-2-yl]ethanamide

Systemtic Name: N-(1-adamantylmethyl)-2-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-2-yl]ethanamide Openeye Name: N-(1-adamantylmethyl)-2-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-2-yl]acetamide CAS Name: N-(1-adamantylmethyl)-2-[4-[(3-fluoro-4-methoxyphenyl)methyl]-2-piperazinyl]acetamide IUPAC Name: N-(1-adamantylmethyl)-2-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-2-yl]acetamide Traditional Name: N-(1-adamantylmethyl)-2-[4-(3-fluoro-4-methoxy-benzyl)piperazin-2-yl]acetamide Formula: C25H36FN3O2 MolecularWeight: 429.570643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCNC(C2)CC(=O)NCC34CC5CC(C3)CC(C5)C4)F

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCNC(C2)CC(=O)NCC34CC5CC(C3)CC(C5)C4)F

InChI

InChI=1S/C25H36FN3O2/c1-31-23-3-2-17(9-22(23)26)14-29-5-4-27-21(15-29)10-24(30)28-16-25-11-18-6-19(12-25)8-20(7-18)13-25/h2-3,9,18-21,27H,4-8,10-16H2,1H3,(H,28,30)