4-[[5-(cyclopropylamino)pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[5-(cyclopropylamino)pyridin-2-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[5-(cyclopropylamino)-2-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[5-(cyclopropylamino)-2-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[5-(cyclopropylamino)pyridin-2-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[5-(cyclopropylamino)-2-pyridyl]amino]-4-keto-butyric acid Formula: C12H15N3O3 MolecularWeight: 249.2658

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=CN=C(C=C2)NC(=O)CCC(=O)O

Isomeric SMILES

C1CC1NC2=CN=C(C=C2)NC(=O)CCC(=O)O

InChI

InChI=1S/C12H15N3O3/c16-11(5-6-12(17)18)15-10-4-3-9(7-13-10)14-8-1-2-8/h3-4,7-8,14H,1-2,5-6H2,(H,17,18)(H,13,15,16)