2-(3-chlorophenyl)-4-[4-(furan-3-ylmethyl)piperazin-1-yl]isoindole-1,3-dione

Systemtic Name: 2-(3-chlorophenyl)-4-[4-(furan-3-ylmethyl)piperazin-1-yl]isoindole-1,3-dione Openeye Name: 2-(3-chlorophenyl)-4-[4-(3-furylmethyl)piperazin-1-yl]isoindoline-1,3-dione CAS Name: 2-(3-chlorophenyl)-4-[4-(3-furanylmethyl)-1-piperazinyl]isoindole-1,3-dione IUPAC Name: 2-(3-chlorophenyl)-4-[4-(furan-3-ylmethyl)piperazin-1-yl]isoindole-1,3-dione Traditional Name: 2-(3-chlorophenyl)-4-[4-(3-furfuryl)piperazino]isoindoline-1,3-quinone Formula: C23H20ClN3O3 MolecularWeight: 421.8762

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=COC=C2)C3=CC=CC4=C3C(=O)N(C4=O)C5=CC(=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=COC=C2)C3=CC=CC4=C3C(=O)N(C4=O)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C23H20ClN3O3/c24-17-3-1-4-18(13-17)27-22(28)19-5-2-6-20(21(19)23(27)29)26-10-8-25(9-11-26)14-16-7-12-30-15-16/h1-7,12-13,15H,8-11,14H2