2,4-bis(chloranyl)-6-[[3-(4-methylpiperazin-4-ium-1-yl)propylazaniumyl]methyl]phenolate

Systemtic Name: 2,4-bis(chloranyl)-6-[[3-(4-methylpiperazin-4-ium-1-yl)propylazaniumyl]methyl]phenolate Openeye Name: 2,4-dichloro-6-[[3-(4-methylpiperazin-4-ium-1-yl)propylammonio]methyl]phenolate CAS Name: 2,4-dichloro-6-[[3-(4-methyl-1-piperazin-4-iumyl)propylammonio]methyl]phenolate IUPAC Name: 2,4-dichloro-6-[[3-(4-methylpiperazin-4-ium-1-yl)propylazaniumyl]methyl]phenolate Traditional Name: 2,4-dichloro-6-[[3-(4-methylpiperazin-4-ium-1-yl)propylammonio]methyl]phenolate Formula: C15H24Cl2N3O+ MolecularWeight: 333.27656

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)CCC[NH2+]CC2=CC(=CC(=C2[O-])Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)CCC[NH2+]CC2=CC(=CC(=C2[O-])Cl)Cl

InChI

InChI=1S/C15H23Cl2N3O/c1-19-5-7-20(8-6-19)4-2-3-18-11-12-9-13(16)10-14(17)15(12)21/h9-10,18,21H,2-8,11H2,1H3/p+1