5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-1-[(3-fluorophenyl)methyl]azepan-2-one

Systemtic Name: 5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-1-[(3-fluorophenyl)methyl]azepan-2-one Openeye Name: 5-[4-(1H-benzimidazol-2-yl)-1-piperidyl]-1-[(3-fluorophenyl)methyl]azepan-2-one CAS Name: 5-[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-1-[(3-fluorophenyl)methyl]-2-azepanone IUPAC Name: 5-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]-1-[(3-fluorophenyl)methyl]azepan-2-one Traditional Name: 5-[4-(1H-benzimidazol-2-yl)piperidino]-1-(3-fluorobenzyl)azepan-2-one Formula: C25H29FN4O MolecularWeight: 420.522363

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(CCC1N2CCC(CC2)C3=NC4=CC=CC=C4N3)CC5=CC(=CC=C5)F

Isomeric SMILES

C1CC(=O)N(CCC1N2CCC(CC2)C3=NC4=CC=CC=C4N3)CC5=CC(=CC=C5)F

InChI

InChI=1S/C25H29FN4O/c26-20-5-3-4-18(16-20)17-30-15-12-21(8-9-24(30)31)29-13-10-19(11-14-29)25-27-22-6-1-2-7-23(22)28-25/h1-7,16,19,21H,8-15,17H2,(H,27,28)