(3R)-3-(2-methyl-1H-indol-3-yl)-2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-3H-isoindol-1-one

Systemtic Name: (3R)-3-(2-methyl-1H-indol-3-yl)-2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxidanylidene-ethyl]-3H-isoindol-1-one Openeye Name: (3R)-3-(2-methyl-1H-indol-3-yl)-2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxo-ethyl]isoindolin-1-one CAS Name: (3R)-3-(2-methyl-1H-indol-3-yl)-2-[2-(4-methyl-1-piperazin-4-iumyl)-2-oxoethyl]-3H-isoindol-1-one IUPAC Name: (3R)-3-(2-methyl-1H-indol-3-yl)-2-[2-(4-methylpiperazin-4-ium-1-yl)-2-oxoethyl]-3H-isoindol-1-one Traditional Name: (3R)-2-[2-keto-2-(4-methylpiperazin-4-ium-1-yl)ethyl]-3-(2-methyl-1H-indol-3-yl)isoindolin-1-one Formula: C24H27N4O2+ MolecularWeight: 403.49678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C3C4=CC=CC=C4C(=O)N3CC(=O)N5CC[NH+](CC5)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)[C@H]3C4=CC=CC=C4C(=O)N3CC(=O)N5CC[NH+](CC5)C

InChI

InChI=1S/C24H26N4O2/c1-16-22(19-9-5-6-10-20(19)25-16)23-17-7-3-4-8-18(17)24(30)28(23)15-21(29)27-13-11-26(2)12-14-27/h3-10,23,25H,11-15H2,1-2H3/p+1/t23-/m1/s1