3-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid

Systemtic Name: 3-[(4-oxidanylidenepyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid Openeye Name: 3-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid CAS Name: 3-[(4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylamino]propanoic acid IUPAC Name: 3-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid Traditional Name: 3-[(4-ketopyrido[1,2-a]pyrimidin-2-yl)methylamino]propionic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1)CNCCC(=O)O

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1)CNCCC(=O)O

InChI

InChI=1S/C12H13N3O3/c16-11-7-9(8-13-5-4-12(17)18)14-10-3-1-2-6-15(10)11/h1-3,6-7,13H,4-5,8H2,(H,17,18)