4-[[4-[5-[(4-fluoranylphenoxy)methyl]furan-2-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[5-[(4-fluoranylphenoxy)methyl]furan-2-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[5-[(4-fluorophenoxy)methyl]furan-2-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[5-[(4-fluorophenoxy)methyl]-2-furanyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[5-[(4-fluorophenoxy)methyl]furan-2-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[5-[(4-fluorophenoxy)methyl]-2-furoyl]piperazino]methyl]benzonitrile Formula: C24H22FN3O3 MolecularWeight: 419.448183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(O3)COC4=CC=C(C=C4)F

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C(=O)C3=CC=C(O3)COC4=CC=C(C=C4)F

InChI

InChI=1S/C24H22FN3O3/c25-20-5-7-21(8-6-20)30-17-22-9-10-23(31-22)24(29)28-13-11-27(12-14-28)16-19-3-1-18(15-26)2-4-19/h1-10H,11-14,16-17H2