2-[(2-chloranylquinazolin-4-yl)amino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[(2-chloranylquinazolin-4-yl)amino]-3-oxidanyl-butanoic acid Openeye Name: 2-[(2-chloroquinazolin-4-yl)amino]-3-hydroxy-butanoic acid CAS Name: 2-[(2-chloro-4-quinazolinyl)amino]-3-hydroxybutanoic acid IUPAC Name: 2-[(2-chloroquinazolin-4-yl)amino]-3-hydroxybutanoic acid Traditional Name: 2-[(2-chloroquinazolin-4-yl)amino]-3-hydroxy-butyric acid Formula: C12H12ClN3O3 MolecularWeight: 281.69498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC1=NC(=NC2=CC=CC=C21)Cl)O

Isomeric SMILES

CC(C(C(=O)O)NC1=NC(=NC2=CC=CC=C21)Cl)O

InChI

InChI=1S/C12H12ClN3O3/c1-6(17)9(11(18)19)15-10-7-4-2-3-5-8(7)14-12(13)16-10/h2-6,9,17H,1H3,(H,18,19)(H,14,15,16)