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

Systemtic Name: [4-[[5-(4-ethylpiperazin-4-ium-1-yl)pyridin-2-yl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[[5-(4-ethylpiperazin-4-ium-1-yl)-2-pyridyl]amino]-4-oxo-butyl]ammonium CAS Name: [4-[[5-(4-ethyl-1-piperazin-4-iumyl)-2-pyridinyl]amino]-4-oxobutyl]ammonium IUPAC Name: [4-[[5-(4-ethylpiperazin-4-ium-1-yl)pyridin-2-yl]amino]-4-oxobutyl]azanium Traditional Name: [4-[[5-(4-ethylpiperazin-4-ium-1-yl)-2-pyridyl]amino]-4-keto-butyl]ammonium Formula: C15H27N5O+2 MolecularWeight: 293.40778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H25N5O/c1-2-19-8-10-20(11-9-19)13-5-6-14(17-12-13)18-15(21)4-3-7-16/h5-6,12H,2-4,7-11,16H2,1H3,(H,17,18,21)/p+2