[4-(diphenylmethyl)piperazin-4-ium-1-yl]-quinoxalin-2-yl-methanone

Systemtic Name: [4-(diphenylmethyl)piperazin-4-ium-1-yl]-quinoxalin-2-yl-methanone Openeye Name: (4-benzhydrylpiperazin-4-ium-1-yl)-quinoxalin-2-yl-methanone CAS Name: [4-(diphenylmethyl)-1-piperazin-4-iumyl]-(2-quinoxalinyl)methanone IUPAC Name: (4-benzhydrylpiperazin-4-ium-1-yl)-quinoxalin-2-ylmethanone Traditional Name: (4-benzhydrylpiperazin-4-ium-1-yl)-quinoxalin-2-yl-methanone Formula: C26H25N4O+ MolecularWeight: 409.5029

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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=NC5=CC=CC=C5N=C4

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=NC5=CC=CC=C5N=C4

InChI

InChI=1S/C26H24N4O/c31-26(24-19-27-22-13-7-8-14-23(22)28-24)30-17-15-29(16-18-30)25(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,19,25H,15-18H2/p+1