[3,5-bis(chloranyl)phenyl]methanamine; 2,4-diphenylpyrimidine-5-carboxylic acid

Systemtic Name: [3,5-bis(chloranyl)phenyl]methanamine; 2,4-diphenylpyrimidine-5-carboxylic acid Openeye Name: (3,5-dichlorophenyl)methanamine; 2,4-diphenylpyrimidine-5-carboxylic acid CAS Name: (3,5-dichlorophenyl)methanamine; 2,4-diphenyl-5-pyrimidinecarboxylic acid IUPAC Name: (3,5-dichlorophenyl)methanamine; 2,4-diphenylpyrimidine-5-carboxylic acid Traditional Name: (3,5-dichlorobenzyl)amine; 2,4-diphenylpyrimidine-5-carboxylic acid Formula: C24H19Cl2N3O2 MolecularWeight: 452.33256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC=C2C(=O)O)C3=CC=CC=C3.C1=C(C=C(C=C1Cl)Cl)CN

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC=C2C(=O)O)C3=CC=CC=C3.C1=C(C=C(C=C1Cl)Cl)CN

InChI

InChI=1S/C17H12N2O2.C7H7Cl2N/c20-17(21)14-11-18-16(13-9-5-2-6-10-13)19-15(14)12-7-3-1-4-8-12;8-6-1-5(4-10)2-7(9)3-6/h1-11H,(H,20,21);1-3H,4,10H2