3-[2-[(1R)-1-(1,2-dimethylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanoylamino]propyl-diethyl-azanium

Systemtic Name: 3-[2-[(1R)-1-(1,2-dimethylindol-3-yl)-3-oxidanylidene-1H-isoindol-2-yl]ethanoylamino]propyl-diethyl-azanium Openeye Name: 3-[[2-[(1R)-1-(1,2-dimethylindol-3-yl)-3-oxo-isoindolin-2-yl]acetyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[2-[(1R)-1-(1,2-dimethyl-3-indolyl)-3-oxo-1H-isoindol-2-yl]-1-oxoethyl]amino]propyl-diethylammonium IUPAC Name: 3-[[2-[(1R)-1-(1,2-dimethylindol-3-yl)-3-oxo-1H-isoindol-2-yl]acetyl]amino]propyl-diethylazanium Traditional Name: 3-[[2-[(1R)-1-(1,2-dimethylindol-3-yl)-3-keto-isoindolin-2-yl]acetyl]amino]propyl-diethyl-ammonium Formula: C27H35N4O2+ MolecularWeight: 447.5924

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)CN1C(C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)CN1[C@H](C2=CC=CC=C2C1=O)C3=C(N(C4=CC=CC=C43)C)C

InChI

InChI=1S/C27H34N4O2/c1-5-30(6-2)17-11-16-28-24(32)18-31-26(20-12-7-8-13-21(20)27(31)33)25-19(3)29(4)23-15-10-9-14-22(23)25/h7-10,12-15,26H,5-6,11,16-18H2,1-4H3,(H,28,32)/p+1/t26-/m1/s1