2-(oxolan-2-ylmethyl)-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione

Systemtic Name: 2-(oxolan-2-ylmethyl)-5-(4-phenylpiperazin-1-yl)carbonyl-isoindole-1,3-dione Openeye Name: 5-(4-phenylpiperazine-1-carbonyl)-2-(tetrahydrofuran-2-ylmethyl)isoindoline-1,3-dione CAS Name: 2-(2-oxolanylmethyl)-5-[oxo-(4-phenyl-1-piperazinyl)methyl]isoindole-1,3-dione IUPAC Name: 2-(oxolan-2-ylmethyl)-5-(4-phenylpiperazine-1-carbonyl)isoindole-1,3-dione Traditional Name: 5-(4-phenylpiperazine-1-carbonyl)-2-(tetrahydrofurfuryl)isoindoline-1,3-quinone Formula: C24H25N3O4 MolecularWeight: 419.473

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C24H25N3O4/c28-22(26-12-10-25(11-13-26)18-5-2-1-3-6-18)17-8-9-20-21(15-17)24(30)27(23(20)29)16-19-7-4-14-31-19/h1-3,5-6,8-9,15,19H,4,7,10-14,16H2