1-(2-methyl-1H-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethane-1,2-dione

Systemtic Name: 1-(2-methyl-1H-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethane-1,2-dione Openeye Name: 1-(2-methyl-1H-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethane-1,2-dione CAS Name: 1-(2-methyl-1H-indol-3-yl)-2-(4-methyl-1-piperazin-4-iumyl)ethane-1,2-dione IUPAC Name: 1-(2-methyl-1H-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethane-1,2-dione Traditional Name: 1-(2-methyl-1H-indol-3-yl)-2-(4-methylpiperazin-4-ium-1-yl)ethane-1,2-dione Formula: C16H20N3O2+ MolecularWeight: 286.3489

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1)C(=O)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1)C(=O)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C16H19N3O2/c1-11-14(12-5-3-4-6-13(12)17-11)15(20)16(21)19-9-7-18(2)8-10-19/h3-6,17H,7-10H2,1-2H3/p+1