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

Systemtic Name: [4-[[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]methyl]phenyl]methyl-dimethyl-azanium Openeye Name: [4-[[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]methyl]phenyl]methyl-dimethyl-ammonium CAS Name: [4-[[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]methyl]phenyl]methyl-dimethylammonium IUPAC Name: [4-[[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]methyl]phenyl]methyl-dimethylazanium Traditional Name: [4-[[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]methyl]benzyl]-dimethyl-ammonium Formula: C22H24N3O3+ MolecularWeight: 378.44426

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

Isomeric SMILES

C[NH+](C)CC1=CC=C(C=C1)CNC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

InChI

InChI=1S/C22H23N3O3/c1-4-11-25-21(27)18-10-9-17(12-19(18)22(25)28)20(26)23-13-15-5-7-16(8-6-15)14-24(2)3/h4-10,12H,1,11,13-14H2,2-3H3,(H,23,26)/p+1