4-(3-pyridin-3-ylpropanoylamino)butanoic acid

Systemtic Name: 4-(3-pyridin-3-ylpropanoylamino)butanoic acid Openeye Name: 4-[3-(3-pyridyl)propanoylamino]butanoic acid CAS Name: 4-[[1-oxo-3-(3-pyridinyl)propyl]amino]butanoic acid IUPAC Name: 4-(3-pyridin-3-ylpropanoylamino)butanoic acid Traditional Name: 4-[3-(3-pyridyl)propanoylamino]butyric acid Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCC(=O)NCCCC(=O)O

Isomeric SMILES

C1=CC(=CN=C1)CCC(=O)NCCCC(=O)O

InChI

InChI=1S/C12H16N2O3/c15-11(14-8-2-4-12(16)17)6-5-10-3-1-7-13-9-10/h1,3,7,9H,2,4-6,8H2,(H,14,15)(H,16,17)