1-(4-methylpiperazin-4-ium-1-yl)-2-(2-phenylindolizin-3-yl)ethane-1,2-dione

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(2-phenylindolizin-3-yl)ethane-1,2-dione Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(2-phenylindolizin-3-yl)ethane-1,2-dione CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-2-(2-phenyl-3-indolizinyl)ethane-1,2-dione IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(2-phenylindolizin-3-yl)ethane-1,2-dione Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(2-phenylindolizin-3-yl)ethane-1,2-dione Formula: C21H22N3O2+ MolecularWeight: 348.41828

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C(=O)C2=C(C=C3N2C=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C(=O)C2=C(C=C3N2C=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3O2/c1-22-11-13-23(14-12-22)21(26)20(25)19-18(16-7-3-2-4-8-16)15-17-9-5-6-10-24(17)19/h2-10,15H,11-14H2,1H3/p+1