2-[(4-morpholin-4-ylcarbonylpiperazin-1-ium-1-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(4-morpholin-4-ylcarbonylpiperazin-1-ium-1-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[[4-(morpholine-4-carbonyl)piperazin-1-ium-1-yl]methyl]isoindoline-1,3-dione CAS Name: 2-[[4-[4-morpholinyl(oxo)methyl]-1-piperazin-1-iumyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[[4-(morpholine-4-carbonyl)piperazin-1-ium-1-yl]methyl]isoindole-1,3-dione Traditional Name: 2-[[4-(morpholine-4-carbonyl)piperazin-1-ium-1-yl]methyl]isoindoline-1,3-quinone Formula: C18H23N4O4+ MolecularWeight: 359.39962

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCOCC4

Isomeric SMILES

C1CN(CC[NH+]1CN2C(=O)C3=CC=CC=C3C2=O)C(=O)N4CCOCC4

InChI

InChI=1S/C18H22N4O4/c23-16-14-3-1-2-4-15(14)17(24)22(16)13-19-5-7-20(8-6-19)18(25)21-9-11-26-12-10-21/h1-4H,5-13H2/p+1