2-[(4-oxidanylidene-4-piperazin-1-yl-butanoyl)amino]ethanesulfonic acid

Systemtic Name: 2-[(4-oxidanylidene-4-piperazin-1-yl-butanoyl)amino]ethanesulfonic acid Openeye Name: 2-[(4-oxo-4-piperazin-1-yl-butanoyl)amino]ethanesulfonic acid CAS Name: 2-[[1,4-dioxo-4-(1-piperazinyl)butyl]amino]ethanesulfonic acid IUPAC Name: 2-[(4-oxo-4-piperazin-1-ylbutanoyl)amino]ethanesulfonic acid Traditional Name: 2-[(4-keto-4-piperazino-butanoyl)amino]ethanesulfonic acid Formula: C10H19N3O5S MolecularWeight: 293.33996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C(=O)CCC(=O)NCCS(=O)(=O)O

Isomeric SMILES

C1CN(CCN1)C(=O)CCC(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C10H19N3O5S/c14-9(12-5-8-19(16,17)18)1-2-10(15)13-6-3-11-4-7-13/h11H,1-8H2,(H,12,14)(H,16,17,18)