3-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid

Systemtic Name: 3-[(7-chloranyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid Openeye Name: 3-[(7-chloro-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid CAS Name: 3-[(7-chloro-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methylamino]propanoic acid IUPAC Name: 3-[(7-chloro-4-oxopyrido[1,2-a]pyrimidin-2-yl)methylamino]propanoic acid Traditional Name: 3-[(7-chloro-4-keto-pyrido[1,2-a]pyrimidin-2-yl)methylamino]propionic acid Formula: C12H12ClN3O3 MolecularWeight: 281.69498

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NC(=CC(=O)N2C=C1Cl)CNCCC(=O)O

Isomeric SMILES

C1=CC2=NC(=CC(=O)N2C=C1Cl)CNCCC(=O)O

InChI

InChI=1S/C12H12ClN3O3/c13-8-1-2-10-15-9(5-11(17)16(10)7-8)6-14-4-3-12(18)19/h1-2,5,7,14H,3-4,6H2,(H,18,19)