2-[(2R)-1-(4-methylpiperazin-4-ium-1-yl)-1-oxidanylidene-propan-2-yl]isoindole-1,3-dione

Systemtic Name: 2-[(2R)-1-(4-methylpiperazin-4-ium-1-yl)-1-oxidanylidene-propan-2-yl]isoindole-1,3-dione Openeye Name: 2-[(1R)-1-methyl-2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]isoindoline-1,3-dione CAS Name: 2-[(2R)-1-(4-methyl-1-piperazin-4-iumyl)-1-oxopropan-2-yl]isoindole-1,3-dione IUPAC Name: 2-[(2R)-1-(4-methylpiperazin-4-ium-1-yl)-1-oxopropan-2-yl]isoindole-1,3-dione Traditional Name: 2-[(1R)-2-keto-1-methyl-2-(4-methylpiperazin-4-ium-1-yl)ethyl]isoindoline-1,3-quinone Formula: C16H20N3O3+ MolecularWeight: 302.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CC[NH+](CC1)C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C[C@H](C(=O)N1CC[NH+](CC1)C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H19N3O3/c1-11(14(20)18-9-7-17(2)8-10-18)19-15(21)12-5-3-4-6-13(12)16(19)22/h3-6,11H,7-10H2,1-2H3/p+1/t11-/m1/s1