4-oxidanylidene-4-(2-piperazin-4-ium-1-ylethylamino)butanoate

Systemtic Name: 4-oxidanylidene-4-(2-piperazin-4-ium-1-ylethylamino)butanoate Openeye Name: 4-oxo-4-(2-piperazin-4-ium-1-ylethylamino)butanoate CAS Name: 4-oxo-4-[2-(1-piperazin-4-iumyl)ethylamino]butanoate IUPAC Name: 4-oxo-4-(2-piperazin-4-ium-1-ylethylamino)butanoate Traditional Name: 4-keto-4-(2-piperazin-4-ium-1-ylethylamino)butyrate Formula: C10H19N3O3 MolecularWeight: 229.27616

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCNC(=O)CCC(=O)[O-]

Isomeric SMILES

C1CN(CC[NH2+]1)CCNC(=O)CCC(=O)[O-]

InChI

InChI=1S/C10H19N3O3/c14-9(1-2-10(15)16)12-5-8-13-6-3-11-4-7-13/h11H,1-8H2,(H,12,14)(H,15,16)