2-azaniumyl-4-oxidanyl-4-oxidanylidene-butanoate; 2,5-bis(azanyl)pentanoate

Systemtic Name: 2-azaniumyl-4-oxidanyl-4-oxidanylidene-butanoate; 2,5-bis(azanyl)pentanoate Openeye Name: 2-azaniumyl-4-hydroxy-4-oxo-butanoate; 2,5-diaminopentanoate CAS Name: 2-ammonio-4-hydroxy-4-oxobutanoate; 2,5-diaminopentanoate IUPAC Name: 2-azaniumyl-4-hydroxy-4-oxobutanoate; 2,5-diaminopentanoate Traditional Name: 2-ammonio-4-hydroxy-4-keto-butyrate; 2,5-diaminovalerate Formula: C9H18N3O6- MolecularWeight: 264.25572

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(C(=O)[O-])N)CN.C(C(C(=O)[O-])[NH3+])C(=O)O

Isomeric SMILES

C(CC(C(=O)[O-])N)CN.C(C(C(=O)[O-])[NH3+])C(=O)O

InChI

InChI=1S/C5H12N2O2.C4H7NO4/c6-3-1-2-4(7)5(8)9;5-2(4(8)9)1-3(6)7/h4H,1-3,6-7H2,(H,8,9);2H,1,5H2,(H,6,7)(H,8,9)/p-1