4-[2-(4-fluoranylphenoxy)ethyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-5-one

Systemtic Name: 4-[2-(4-fluoranylphenoxy)ethyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-5-one Openeye Name: 4-[2-(4-fluorophenoxy)ethyl]-1-(3-pyridylmethyl)-1,4-diazepan-5-one CAS Name: 4-[2-(4-fluorophenoxy)ethyl]-1-(3-pyridinylmethyl)-1,4-diazepan-5-one IUPAC Name: 4-[2-(4-fluorophenoxy)ethyl]-1-(pyridin-3-ylmethyl)-1,4-diazepan-5-one Traditional Name: 4-[2-(4-fluorophenoxy)ethyl]-1-(3-pyridylmethyl)-1,4-diazepan-5-one Formula: C19H22FN3O2 MolecularWeight: 343.395283

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CCOC2=CC=C(C=C2)F)CC3=CN=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)CCOC2=CC=C(C=C2)F)CC3=CN=CC=C3

InChI

InChI=1S/C19H22FN3O2/c20-17-3-5-18(6-4-17)25-13-12-23-11-10-22(9-7-19(23)24)15-16-2-1-8-21-14-16/h1-6,8,14H,7,9-13,15H2