[4-[[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium

Systemtic Name: [4-[[[2-butyl-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[(2-butyl-1,3-dioxo-isoindoline-5-carbonyl)amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[(2-butyl-1,3-dioxo-5-isoindolyl)-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[(2-butyl-1,3-dioxoisoindole-5-carbonyl)amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[(2-butyl-1,3-diketo-isoindoline-5-carbonyl)amino]methyl]benzyl]-dimethyl-ammonium Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C[NH+](C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NCC3=CC=C(C=C3)C[NH+](C)C

InChI

InChI=1S/C23H27N3O3/c1-4-5-12-26-22(28)19-11-10-18(13-20(19)23(26)29)21(27)24-14-16-6-8-17(9-7-16)15-25(2)3/h6-11,13H,4-5,12,14-15H2,1-3H3,(H,24,27)/p+1