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

Systemtic Name: (2S)-2-[(4-oxidanylidenequinazolin-3-yl)methylamino]pentanoic acid dihydrochloride Openeye Name: (2S)-2-[(4-oxoquinazolin-3-yl)methylamino]pentanoic acid dihydrochloride CAS Name: (2S)-2-[(4-oxo-3-quinazolinyl)methylamino]pentanoic acid dihydrochloride IUPAC Name: (2S)-2-[(4-oxoquinazolin-3-yl)methylamino]pentanoic acid dihydrochloride Traditional Name: (2S)-2-[(4-ketoquinazolin-3-yl)methylamino]valeric acid dihydrochloride Formula: C14H19Cl2N3O3 MolecularWeight: 348.22496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17N3O3.2ClH/c1-2-5-12(14(19)20)16-9-17-8-15-11-7-4-3-6-10(11)13(17)18;;/h3-4,6-8,12,16H,2,5,9H2,1H3,(H,19,20);2*1H/t12-;;/m0../s1