[4-[[5-(4-methylpiperazin-4-ium-1-yl)pyridin-2-yl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[5-(4-methylpiperazin-4-ium-1-yl)pyridin-2-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[5-(4-methylpiperazin-4-ium-1-yl)-2-pyridyl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[5-(4-methyl-1-piperazin-4-iumyl)-2-pyridinyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[5-(4-methylpiperazin-4-ium-1-yl)pyridin-2-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-keto-4-[[5-(4-methylpiperazin-4-ium-1-yl)-2-pyridyl]amino]butyl]ammonium Formula: C14H25N5O+2 MolecularWeight: 279.3812

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CN=C(C=C2)NC(=O)CCC[NH3+]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CN=C(C=C2)NC(=O)CCC[NH3+]

InChI

InChI=1S/C14H23N5O/c1-18-7-9-19(10-8-18)12-4-5-13(16-11-12)17-14(20)3-2-6-15/h4-5,11H,2-3,6-10,15H2,1H3,(H,16,17,20)/p+2