4-[[2-[4-(furan-3-ylcarbonyl)piperazin-1-yl]-1-(3-pyrrolidin-1-ylphenyl)ethoxy]methyl]benzenecarbonitrile

Systemtic Name: 4-[[2-[4-(furan-3-ylcarbonyl)piperazin-1-yl]-1-(3-pyrrolidin-1-ylphenyl)ethoxy]methyl]benzenecarbonitrile Openeye Name: 4-[[2-[4-(furan-3-carbonyl)piperazin-1-yl]-1-(3-pyrrolidin-1-ylphenyl)ethoxy]methyl]benzonitrile CAS Name: 4-[[2-[4-[3-furanyl(oxo)methyl]-1-piperazinyl]-1-[3-(1-pyrrolidinyl)phenyl]ethoxy]methyl]benzonitrile IUPAC Name: 4-[[2-[4-(furan-3-carbonyl)piperazin-1-yl]-1-(3-pyrrolidin-1-ylphenyl)ethoxy]methyl]benzonitrile Traditional Name: 4-[[2-[4-(3-furoyl)piperazino]-1-(3-pyrrolidinophenyl)ethoxy]methyl]benzonitrile Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC=CC(=C2)C(CN3CCN(CC3)C(=O)C4=COC=C4)OCC5=CC=C(C=C5)C#N

Isomeric SMILES

C1CCN(C1)C2=CC=CC(=C2)C(CN3CCN(CC3)C(=O)C4=COC=C4)OCC5=CC=C(C=C5)C#N

InChI

InChI=1S/C29H32N4O3/c30-19-23-6-8-24(9-7-23)21-36-28(25-4-3-5-27(18-25)32-11-1-2-12-32)20-31-13-15-33(16-14-31)29(34)26-10-17-35-22-26/h3-10,17-18,22,28H,1-2,11-16,20-21H2