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

Systemtic Name: methyl 4-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoate Openeye Name: methyl 4-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoate CAS Name: 4-[[2-(2-chlorophenyl)-4-quinazolinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoate Traditional Name: 4-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoic acid methyl ester Formula: C22H16ClN3O2 MolecularWeight: 389.83434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H16ClN3O2/c1-28-22(27)14-10-12-15(13-11-14)24-21-17-7-3-5-9-19(17)25-20(26-21)16-6-2-4-8-18(16)23/h2-13H,1H3,(H,24,25,26)