6-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2,4-dimethyl-1,2,4-triazine-3,5-dione

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2,4-dimethyl-1,2,4-triazine-3,5-dione Openeye Name: 6-(4-benzhydrylpiperazin-4-ium-1-yl)-2,4-dimethyl-1,2,4-triazine-3,5-dione CAS Name: 6-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2,4-dimethyl-1,2,4-triazine-3,5-dione IUPAC Name: 6-(4-benzhydrylpiperazin-4-ium-1-yl)-2,4-dimethyl-1,2,4-triazine-3,5-dione Traditional Name: 6-(4-benzhydrylpiperazin-4-ium-1-yl)-2,4-dimethyl-1,2,4-triazine-3,5-quinone Formula: C22H26N5O2+ MolecularWeight: 392.47414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=NN(C1=O)C)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C(=NN(C1=O)C)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H25N5O2/c1-24-21(28)20(23-25(2)22(24)29)27-15-13-26(14-16-27)19(17-9-5-3-6-10-17)18-11-7-4-8-12-18/h3-12,19H,13-16H2,1-2H3/p+1