4-(diethylamino)-N'-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanoyl]benzohydrazide

Systemtic Name: 4-(diethylamino)-N'-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)ethanoyl]benzohydrazide Openeye Name: 4-(diethylamino)-N'-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetyl]benzohydrazide CAS Name: 4-(diethylamino)-N'-[1-oxo-2-[4-(2-pyridin-1-iumyl)-1-piperazin-1-iumyl]ethyl]benzohydrazide IUPAC Name: 4-(diethylamino)-N'-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetyl]benzohydrazide Traditional Name: 4-(diethylamino)-N'-[2-(4-pyridin-1-ium-2-ylpiperazin-1-ium-1-yl)acetyl]benzohydrazide Formula: C22H32N6O2+2 MolecularWeight: 412.52848

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=O)C[NH+]2CCN(CC2)C3=CC=CC=[NH+]3

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NNC(=O)C[NH+]2CCN(CC2)C3=CC=CC=[NH+]3

InChI

InChI=1S/C22H30N6O2/c1-3-27(4-2)19-10-8-18(9-11-19)22(30)25-24-21(29)17-26-13-15-28(16-14-26)20-7-5-6-12-23-20/h5-12H,3-4,13-17H2,1-2H3,(H,24,29)(H,25,30)/p+2