3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoic acid

Systemtic Name: 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoic acid Openeye Name: 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoic acid CAS Name: 3-[[2-(2-chlorophenyl)-4-quinazolinyl]amino]benzoic acid IUPAC Name: 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoic acid Traditional Name: 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoic acid Formula: C21H14ClN3O2 MolecularWeight: 375.80776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CC=C3Cl)NC4=CC=CC(=C4)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CC=C3Cl)NC4=CC=CC(=C4)C(=O)O

InChI

InChI=1S/C21H14ClN3O2/c22-17-10-3-1-8-15(17)19-24-18-11-4-2-9-16(18)20(25-19)23-14-7-5-6-13(12-14)21(26)27/h1-12H,(H,26,27)(H,23,24,25)