3-[4-[(4-chlorophenyl)amino]phenyl]-2,2-dicyano-propanoic acid

Systemtic Name: 3-[4-[(4-chlorophenyl)amino]phenyl]-2,2-dicyano-propanoic acid Openeye Name: 3-[4-(4-chloroanilino)phenyl]-2,2-dicyano-propanoic acid CAS Name: 3-[4-(4-chloroanilino)phenyl]-2,2-dicyanopropanoic acid IUPAC Name: 3-[4-(4-chloroanilino)phenyl]-2,2-dicyanopropanoic acid Traditional Name: 3-[4-(4-chloroanilino)phenyl]-2,2-dicyano-propionic acid Formula: C17H12ClN3O2 MolecularWeight: 325.74908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C#N)(C#N)C(=O)O)NC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1CC(C#N)(C#N)C(=O)O)NC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H12ClN3O2/c18-13-3-7-15(8-4-13)21-14-5-1-12(2-6-14)9-17(10-19,11-20)16(22)23/h1-8,21H,9H2,(H,22,23)