2-[[1-[(4-chlorophenyl)-(furan-2-yl)methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one

Systemtic Name: 2-[[1-[(4-chlorophenyl)-(furan-2-yl)methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Openeye Name: 2-[[1-[(4-chlorophenyl)-(2-furyl)methyl]-4-piperidyl]methyl]isoindolin-1-one CAS Name: 2-[[1-[(4-chlorophenyl)-(2-furanyl)methyl]-4-piperidinyl]methyl]-3H-isoindol-1-one IUPAC Name: 2-[[1-[(4-chlorophenyl)-(furan-2-yl)methyl]piperidin-4-yl]methyl]-3H-isoindol-1-one Traditional Name: 2-[[1-[(4-chlorophenyl)-(2-furyl)methyl]-4-piperidyl]methyl]isoindolin-1-one Formula: C25H25ClN2O2 MolecularWeight: 420.9312

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)C(C4=CC=C(C=C4)Cl)C5=CC=CO5

Isomeric SMILES

C1CN(CCC1CN2CC3=CC=CC=C3C2=O)C(C4=CC=C(C=C4)Cl)C5=CC=CO5

InChI

InChI=1S/C25H25ClN2O2/c26-21-9-7-19(8-10-21)24(23-6-3-15-30-23)27-13-11-18(12-14-27)16-28-17-20-4-1-2-5-22(20)25(28)29/h1-10,15,18,24H,11-14,16-17H2