1-(4-methylpiperazin-4-ium-1-yl)-4-(4-phenylphenyl)butane-1,4-dione

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-4-(4-phenylphenyl)butane-1,4-dione Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-4-(4-phenylphenyl)butane-1,4-dione CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-4-(4-phenylphenyl)butane-1,4-dione IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-4-(4-phenylphenyl)butane-1,4-dione Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-4-(4-phenylphenyl)butane-1,4-dione Formula: C21H25N2O2+ MolecularWeight: 337.4354

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)CCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)CCC(=O)C2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O2/c1-22-13-15-23(16-14-22)21(25)12-11-20(24)19-9-7-18(8-10-19)17-5-3-2-4-6-17/h2-10H,11-16H2,1H3/p+1