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

Systemtic Name: 4-oxidanylidene-4-[[6-(pyridin-4-ylmethylamino)pyridin-3-yl]amino]butanoate Openeye Name: 4-oxo-4-[[6-(4-pyridylmethylamino)-3-pyridyl]amino]butanoate CAS Name: 4-oxo-4-[[6-(pyridin-4-ylmethylamino)-3-pyridinyl]amino]butanoate IUPAC Name: 4-oxo-4-[[6-(pyridin-4-ylmethylamino)pyridin-3-yl]amino]butanoate Traditional Name: 4-keto-4-[[6-(4-pyridylmethylamino)-3-pyridyl]amino]butyrate Formula: C15H15N4O3- MolecularWeight: 299.3046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1NC(=O)CCC(=O)[O-])NCC2=CC=NC=C2

Isomeric SMILES

C1=CC(=NC=C1NC(=O)CCC(=O)[O-])NCC2=CC=NC=C2

InChI

InChI=1S/C15H16N4O3/c20-14(3-4-15(21)22)19-12-1-2-13(18-10-12)17-9-11-5-7-16-8-6-11/h1-2,5-8,10H,3-4,9H2,(H,17,18)(H,19,20)(H,21,22)/p-1