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

Systemtic Name: methyl 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoate chloride Openeye Name: methyl 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoate chloride CAS Name: 3-[[2-(2-chlorophenyl)-4-quinazolinyl]amino]benzoic acid methyl ester chloride IUPAC Name: methyl 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoate chloride Traditional Name: 3-[[2-(2-chlorophenyl)quinazolin-4-yl]amino]benzoic acid methyl ester chloride Formula: C22H16Cl2N3O2- MolecularWeight: 425.28734

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl.[Cl-]

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=CC=CC=C32)C4=CC=CC=C4Cl.[Cl-]

InChI

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