4-oxidanylidene-4-[[6-(propylamino)pyridin-3-yl]amino]butanoate

Systemtic Name: 4-oxidanylidene-4-[[6-(propylamino)pyridin-3-yl]amino]butanoate Openeye Name: 4-oxo-4-[[6-(propylamino)-3-pyridyl]amino]butanoate CAS Name: 4-oxo-4-[[6-(propylamino)-3-pyridinyl]amino]butanoate IUPAC Name: 4-oxo-4-[[6-(propylamino)pyridin-3-yl]amino]butanoate Traditional Name: 4-keto-4-[[6-(propylamino)-3-pyridyl]amino]butyrate Formula: C12H16N3O3- MolecularWeight: 250.27374

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC=C(C=C1)NC(=O)CCC(=O)[O-]

Isomeric SMILES

CCCNC1=NC=C(C=C1)NC(=O)CCC(=O)[O-]

InChI

InChI=1S/C12H17N3O3/c1-2-7-13-10-4-3-9(8-14-10)15-11(16)5-6-12(17)18/h3-4,8H,2,5-7H2,1H3,(H,13,14)(H,15,16)(H,17,18)/p-1