4-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]butanoic acid

Systemtic Name: 4-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]butanoic acid Openeye Name: 4-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]butanoic acid CAS Name: 4-[[2-(4-chlorophenyl)-4-quinazolinyl]amino]butanoic acid IUPAC Name: 4-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]butanoic acid Traditional Name: 4-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]butyric acid Formula: C18H16ClN3O2 MolecularWeight: 341.79154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)NCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)NCCCC(=O)O

InChI

InChI=1S/C18H16ClN3O2/c19-13-9-7-12(8-10-13)17-21-15-5-2-1-4-14(15)18(22-17)20-11-3-6-16(23)24/h1-2,4-5,7-10H,3,6,11H2,(H,23,24)(H,20,21,22)