4-oxidanylidene-4-piperazin-4-ium-1-yl-N-(pyridin-4-ylmethyl)butanamide

Systemtic Name: 4-oxidanylidene-4-piperazin-4-ium-1-yl-N-(pyridin-4-ylmethyl)butanamide Openeye Name: 4-oxo-4-piperazin-4-ium-1-yl-N-(4-pyridylmethyl)butanamide CAS Name: 4-oxo-4-(1-piperazin-4-iumyl)-N-(pyridin-4-ylmethyl)butanamide IUPAC Name: 4-oxo-4-piperazin-4-ium-1-yl-N-(pyridin-4-ylmethyl)butanamide Traditional Name: 4-keto-4-piperazin-4-ium-1-yl-N-(4-pyridylmethyl)butyramide Formula: C14H21N4O2+ MolecularWeight: 277.34214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)CCC(=O)NCC2=CC=NC=C2

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)CCC(=O)NCC2=CC=NC=C2

InChI

InChI=1S/C14H20N4O2/c19-13(17-11-12-3-5-15-6-4-12)1-2-14(20)18-9-7-16-8-10-18/h3-6,16H,1-2,7-11H2,(H,17,19)/p+1