4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-(1H-imidazol-5-yl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-(1H-imidazol-5-yl)ethylamino]-4-keto-butyric acid Formula: C9H13N3O3 MolecularWeight: 211.21782

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(NC=N1)CCNC(=O)CCC(=O)O

Isomeric SMILES

C1=C(NC=N1)CCNC(=O)CCC(=O)O

InChI

InChI=1S/C9H13N3O3/c13-8(1-2-9(14)15)11-4-3-7-5-10-6-12-7/h5-6H,1-4H2,(H,10,12)(H,11,13)(H,14,15)