(4-methylpiperazin-4-ium-1-yl)-[4-(piperazin-4-ium-1-ylmethyl)phenyl]methanone

Systemtic Name: (4-methylpiperazin-4-ium-1-yl)-[4-(piperazin-4-ium-1-ylmethyl)phenyl]methanone Openeye Name: (4-methylpiperazin-4-ium-1-yl)-[4-(piperazin-4-ium-1-ylmethyl)phenyl]methanone CAS Name: (4-methyl-1-piperazin-4-iumyl)-[4-(1-piperazin-4-iumylmethyl)phenyl]methanone IUPAC Name: (4-methylpiperazin-4-ium-1-yl)-[4-(piperazin-4-ium-1-ylmethyl)phenyl]methanone Traditional Name: (4-methylpiperazin-4-ium-1-yl)-[4-(piperazin-4-ium-1-ylmethyl)phenyl]methanone Formula: C17H28N4O+2 MolecularWeight: 304.43042

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CC[NH2+]CC3

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)C2=CC=C(C=C2)CN3CC[NH2+]CC3

InChI

InChI=1S/C17H26N4O/c1-19-10-12-21(13-11-19)17(22)16-4-2-15(3-5-16)14-20-8-6-18-7-9-20/h2-5,18H,6-14H2,1H3/p+2