(2S)-2-[(4-oxidanylidenequinazolin-3-yl)methylamino]propanoic acid dihydrochloride

Systemtic Name: (2S)-2-[(4-oxidanylidenequinazolin-3-yl)methylamino]propanoic acid dihydrochloride Openeye Name: (2S)-2-[(4-oxoquinazolin-3-yl)methylamino]propanoic acid dihydrochloride CAS Name: (2S)-2-[(4-oxo-3-quinazolinyl)methylamino]propanoic acid dihydrochloride IUPAC Name: (2S)-2-[(4-oxoquinazolin-3-yl)methylamino]propanoic acid dihydrochloride Traditional Name: (2S)-2-[(4-ketoquinazolin-3-yl)methylamino]propionic acid dihydrochloride Formula: C12H15Cl2N3O3 MolecularWeight: 320.1718

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)NCN1C=NC2=CC=CC=C2C1=O.Cl.Cl

Isomeric SMILES

C[C@@H](C(=O)O)NCN1C=NC2=CC=CC=C2C1=O.Cl.Cl

InChI

InChI=1S/C12H13N3O3.2ClH/c1-8(12(17)18)13-6-15-7-14-10-5-3-2-4-9(10)11(15)16;;/h2-5,7-8,13H,6H2,1H3,(H,17,18);2*1H/t8-;;/m0../s1