2-[3-[(1R)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanoylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[3-[(1R)-1-(1H-indol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]propanoylamino]ethyl-dimethyl-azanium Openeye Name: 2-[3-[(1R)-1-(1H-indol-3-yl)-3-oxo-isoindolin-2-yl]propanoylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[3-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-1-oxopropyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[3-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]propanoylamino]ethyl-dimethylazanium Traditional Name: 2-[3-[(1R)-1-(1H-indol-3-yl)-3-keto-isoindolin-2-yl]propanoylamino]ethyl-dimethyl-ammonium Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=O)CCN1C(C2=CC=CC=C2C1=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

C[NH+](C)CCNC(=O)CCN1[C@H](C2=CC=CC=C2C1=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H26N4O2/c1-26(2)14-12-24-21(28)11-13-27-22(17-8-3-4-9-18(17)23(27)29)19-15-25-20-10-6-5-7-16(19)20/h3-10,15,22,25H,11-14H2,1-2H3,(H,24,28)/p+1/t22-/m1/s1