2-[2-(4-chlorophenyl)quinolin-6-yl]-2-cyano-propanoic acid

Systemtic Name: 2-[2-(4-chlorophenyl)quinolin-6-yl]-2-cyano-propanoic acid Openeye Name: 2-[2-(4-chlorophenyl)-6-quinolyl]-2-cyano-propanoic acid CAS Name: 2-[2-(4-chlorophenyl)-6-quinolinyl]-2-cyanopropanoic acid IUPAC Name: 2-[2-(4-chlorophenyl)quinolin-6-yl]-2-cyanopropanoic acid Traditional Name: 2-[2-(4-chlorophenyl)-6-quinolyl]-2-cyano-propionic acid Formula: C19H13ClN2O2 MolecularWeight: 336.77172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1=CC2=C(C=C1)N=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC(C#N)(C1=CC2=C(C=C1)N=C(C=C2)C3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C19H13ClN2O2/c1-19(11-21,18(23)24)14-5-9-17-13(10-14)4-8-16(22-17)12-2-6-15(20)7-3-12/h2-10H,1H3,(H,23,24)