2-[[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-pyridazine-3,6-dione

Systemtic Name: 2-[[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]methyl]-1H-pyridazine-3,6-dione Openeye Name: 2-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]-1H-pyridazine-3,6-dione CAS Name: 2-[[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-1H-pyridazine-3,6-dione IUPAC Name: 2-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]-1H-pyridazine-3,6-dione Traditional Name: 2-[(4-benzhydrylpiperazine-1,4-diium-1-yl)methyl]-1H-pyridazine-3,6-quinone Formula: C22H26N4O2+2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CN2C(=O)C=CC(=O)N2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC[NH+]1CN2C(=O)C=CC(=O)N2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2/c27-20-11-12-21(28)26(23-20)17-24-13-15-25(16-14-24)22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-12,22H,13-17H2,(H,23,27)/p+2