5-[1-adamantylmethyl(methyl)amino]-1-[(2-fluorophenyl)methyl]azepan-2-one

Systemtic Name: 5-[1-adamantylmethyl(methyl)amino]-1-[(2-fluorophenyl)methyl]azepan-2-one Openeye Name: 5-[1-adamantylmethyl(methyl)amino]-1-[(2-fluorophenyl)methyl]azepan-2-one CAS Name: 5-[1-adamantylmethyl(methyl)amino]-1-[(2-fluorophenyl)methyl]-2-azepanone IUPAC Name: 5-[1-adamantylmethyl(methyl)amino]-1-[(2-fluorophenyl)methyl]azepan-2-one Traditional Name: 5-[1-adamantylmethyl(methyl)amino]-1-(2-fluorobenzyl)azepan-2-one Formula: C25H35FN2O MolecularWeight: 398.556603

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC12CC3CC(C1)CC(C3)C2)C4CCC(=O)N(CC4)CC5=CC=CC=C5F

Isomeric SMILES

CN(CC12CC3CC(C1)CC(C3)C2)C4CCC(=O)N(CC4)CC5=CC=CC=C5F

InChI

InChI=1S/C25H35FN2O/c1-27(17-25-13-18-10-19(14-25)12-20(11-18)15-25)22-6-7-24(29)28(9-8-22)16-21-4-2-3-5-23(21)26/h2-5,18-20,22H,6-17H2,1H3