2-chloranylbenzoic acid; N4-(4-chlorophenyl)-N2,N2-dimethyl-quinazoline-2,4-diamine

Systemtic Name: 2-chloranylbenzoic acid; N4-(4-chlorophenyl)-N2,N2-dimethyl-quinazoline-2,4-diamine Openeye Name: 2-chlorobenzoic acid; N4-(4-chlorophenyl)-N2,N2-dimethyl-quinazoline-2,4-diamine CAS Name: 2-chlorobenzoic acid; N4-(4-chlorophenyl)-N2,N2-dimethylquinazoline-2,4-diamine IUPAC Name: 2-chlorobenzoic acid; 4-N-(4-chlorophenyl)-2-N,2-N-dimethylquinazoline-2,4-diamine Traditional Name: [4-(4-chloroanilino)quinazolin-2-yl]-dimethyl-amine; 2-chlorobenzoic acid Formula: C23H20Cl2N4O2 MolecularWeight: 455.3365

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)Cl.C1=CC=C(C(=C1)C(=O)O)Cl

Isomeric SMILES

CN(C)C1=NC2=CC=CC=C2C(=N1)NC3=CC=C(C=C3)Cl.C1=CC=C(C(=C1)C(=O)O)Cl

InChI

InChI=1S/C16H15ClN4.C7H5ClO2/c1-21(2)16-19-14-6-4-3-5-13(14)15(20-16)18-12-9-7-11(17)8-10-12;8-6-4-2-1-3-5(6)7(9)10/h3-10H,1-2H3,(H,18,19,20);1-4H,(H,9,10)