4-[(6-chloranylquinazolin-4-yl)amino]butanoic acid

Systemtic Name: 4-[(6-chloranylquinazolin-4-yl)amino]butanoic acid Openeye Name: 4-[(6-chloroquinazolin-4-yl)amino]butanoic acid CAS Name: 4-[(6-chloro-4-quinazolinyl)amino]butanoic acid IUPAC Name: 4-[(6-chloroquinazolin-4-yl)amino]butanoic acid Traditional Name: 4-[(6-chloroquinazolin-4-yl)amino]butyric acid Formula: C12H12ClN3O2 MolecularWeight: 265.69558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1Cl)C(=NC=N2)NCCCC(=O)O

Isomeric SMILES

C1=CC2=C(C=C1Cl)C(=NC=N2)NCCCC(=O)O

InChI

InChI=1S/C12H12ClN3O2/c13-8-3-4-10-9(6-8)12(16-7-15-10)14-5-1-2-11(17)18/h3-4,6-7H,1-2,5H2,(H,17,18)(H,14,15,16)