6-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonyl-2-(phenylmethyl)pyridazin-3-one

Systemtic Name: 6-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonyl-2-(phenylmethyl)pyridazin-3-one Openeye Name: 6-(4-benzhydrylpiperazin-4-ium-1-carbonyl)-2-benzyl-pyridazin-3-one CAS Name: 6-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]-2-(phenylmethyl)-3-pyridazinone IUPAC Name: 6-(4-benzhydrylpiperazin-4-ium-1-carbonyl)-2-benzylpyridazin-3-one Traditional Name: 6-(4-benzhydrylpiperazin-4-ium-1-carbonyl)-2-benzyl-pyridazin-3-one Formula: C29H29N4O2+ MolecularWeight: 465.56616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=NN(C(=O)C=C4)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2/c34-27-17-16-26(30-33(27)22-23-10-4-1-5-11-23)29(35)32-20-18-31(19-21-32)28(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-17,28H,18-22H2/p+1