2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone; 2-oxidanyl-2-oxidanylidene-ethanoate

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone; 2-oxidanyl-2-oxidanylidene-ethanoate Openeye Name: 2-hydroxy-2-oxo-acetate; 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-(2-methylindolin-1-yl)ethanone CAS Name: 2-hydroxy-2-oxoacetate; 2-[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone IUPAC Name: 2-hydroxy-2-oxoacetate; 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-(2-methyl-2,3-dihydroindol-1-yl)ethanone Traditional Name: 2-[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]-1-(2-methylindolin-1-yl)ethanone binoxalate Formula: C24H29N3O6 MolecularWeight: 455.50356

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)OC.C(=O)(C(=O)[O-])O

Isomeric SMILES

CC1CC2=CC=CC=C2N1C(=O)C[NH+]3CCN(CC3)C4=CC=C(C=C4)OC.C(=O)(C(=O)[O-])O

InChI

InChI=1S/C22H27N3O2.C2H2O4/c1-17-15-18-5-3-4-6-21(18)25(17)22(26)16-23-11-13-24(14-12-23)19-7-9-20(27-2)10-8-19;3-1(4)2(5)6/h3-10,17H,11-16H2,1-2H3;(H,3,4)(H,5,6)