2-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-morpholin-4-yl-isoindole-1,3-dione

Systemtic Name: 2-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-morpholin-4-yl-isoindole-1,3-dione Openeye Name: 2-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-morpholino-isoindoline-1,3-dione CAS Name: 2-[2-[2-(4-methyl-1-piperazinyl)phenyl]ethyl]-5-(4-morpholinyl)isoindole-1,3-dione IUPAC Name: 2-[2-[2-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-morpholin-4-ylisoindole-1,3-dione Traditional Name: 2-[2-[2-(4-methylpiperazino)phenyl]ethyl]-5-morpholino-isoindoline-1,3-quinone Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2CCN3C(=O)C4=C(C3=O)C=C(C=C4)N5CCOCC5

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2CCN3C(=O)C4=C(C3=O)C=C(C=C4)N5CCOCC5

InChI

InChI=1S/C25H30N4O3/c1-26-10-12-28(13-11-26)23-5-3-2-4-19(23)8-9-29-24(30)21-7-6-20(18-22(21)25(29)31)27-14-16-32-17-15-27/h2-7,18H,8-17H2,1H3