1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone

Systemtic Name: 1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Openeye Name: 1-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone CAS Name: 1-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]-2-(4-phenyl-1-piperazin-1-iumyl)ethanone IUPAC Name: 1-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Traditional Name: 1-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]-2-(4-phenylpiperazin-1-ium-1-yl)ethanone Formula: C24H34N4O+2 MolecularWeight: 394.55296

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C(=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C24H32N4O/c1-21-7-5-6-8-22(21)19-25-13-17-28(18-14-25)24(29)20-26-11-15-27(16-12-26)23-9-3-2-4-10-23/h2-10H,11-20H2,1H3/p+2