(3-methoxyphenyl)-[4-(4-methylpiperazine-1,4-diium-1-yl)piperidin-1-yl]methanone

Systemtic Name: (3-methoxyphenyl)-[4-(4-methylpiperazine-1,4-diium-1-yl)piperidin-1-yl]methanone Openeye Name: (3-methoxyphenyl)-[4-(4-methylpiperazine-1,4-diium-1-yl)-1-piperidyl]methanone CAS Name: (3-methoxyphenyl)-[4-(4-methyl-1-piperazine-1,4-diiumyl)-1-piperidinyl]methanone IUPAC Name: (3-methoxyphenyl)-[4-(4-methylpiperazine-1,4-diium-1-yl)piperidin-1-yl]methanone Traditional Name: (3-methoxyphenyl)-[4-(4-methylpiperazine-1,4-diium-1-yl)piperidino]methanone Formula: C18H29N3O2+2 MolecularWeight: 319.44176

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

C[NH+]1CC[NH+](CC1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C18H27N3O2/c1-19-10-12-20(13-11-19)16-6-8-21(9-7-16)18(22)15-4-3-5-17(14-15)23-2/h3-5,14,16H,6-13H2,1-2H3/p+2