1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-(1H-indol-3-yl)ethane-1,2-dione

Systemtic Name: 1-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-(1H-indol-3-yl)ethane-1,2-dione Openeye Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(1H-indol-3-yl)ethane-1,2-dione CAS Name: 1-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-(1H-indol-3-yl)ethane-1,2-dione IUPAC Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(1H-indol-3-yl)ethane-1,2-dione Traditional Name: 1-(4-benzhydrylpiperazin-4-ium-1-yl)-2-(1H-indol-3-yl)ethane-1,2-dione Formula: C27H26N3O2+ MolecularWeight: 424.51424

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C(=O)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C(=O)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C27H25N3O2/c31-26(23-19-28-24-14-8-7-13-22(23)24)27(32)30-17-15-29(16-18-30)25(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,19,25,28H,15-18H2/p+1