methyl 4-[(2-phenylquinazolin-4-yl)amino]benzoate hydrochloride

Systemtic Name: methyl 4-[(2-phenylquinazolin-4-yl)amino]benzoate hydrochloride Openeye Name: methyl 4-[(2-phenylquinazolin-4-yl)amino]benzoate hydrochloride CAS Name: 4-[(2-phenyl-4-quinazolinyl)amino]benzoic acid methyl ester hydrochloride IUPAC Name: methyl 4-[(2-phenylquinazolin-4-yl)amino]benzoate hydrochloride Traditional Name: 4-[(2-phenylquinazolin-4-yl)amino]benzoic acid methyl ester hydrochloride Formula: C22H18ClN3O2 MolecularWeight: 391.85022

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17N3O2.ClH/c1-27-22(26)16-11-13-17(14-12-16)23-21-18-9-5-6-10-19(18)24-20(25-21)15-7-3-2-4-8-15;/h2-14H,1H3,(H,23,24,25);1H