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

Systemtic Name: 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]benzoate Openeye Name: 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]benzoate CAS Name: 3-[[2-(4-chlorophenyl)-4-quinazolinyl]amino]benzoate IUPAC Name: 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]benzoate Traditional Name: 3-[[2-(4-chlorophenyl)quinazolin-4-yl]amino]benzoate Formula: C21H13ClN3O2- MolecularWeight: 374.79982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)NC4=CC=CC(=C4)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=C(C=C3)Cl)NC4=CC=CC(=C4)C(=O)[O-]

InChI

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