3-(2-chloranyl-7,8-dimethyl-quinolin-3-yl)-2-cyano-N-(4-fluorophenyl)propanamide

Systemtic Name: 3-(2-chloranyl-7,8-dimethyl-quinolin-3-yl)-2-cyano-N-(4-fluorophenyl)propanamide Openeye Name: 3-(2-chloro-7,8-dimethyl-3-quinolyl)-2-cyano-N-(4-fluorophenyl)propanamide CAS Name: 3-(2-chloro-7,8-dimethyl-3-quinolinyl)-2-cyano-N-(4-fluorophenyl)propanamide IUPAC Name: 3-(2-chloro-7,8-dimethylquinolin-3-yl)-2-cyano-N-(4-fluorophenyl)propanamide Traditional Name: 3-(2-chloro-7,8-dimethyl-3-quinolyl)-2-cyano-N-(4-fluorophenyl)propionamide Formula: C21H17ClFN3O MolecularWeight: 381.830583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NC(=C(C=C2C=C1)CC(C#N)C(=O)NC3=CC=C(C=C3)F)Cl)C

Isomeric SMILES

CC1=C(C2=NC(=C(C=C2C=C1)CC(C#N)C(=O)NC3=CC=C(C=C3)F)Cl)C

InChI

InChI=1S/C21H17ClFN3O/c1-12-3-4-14-9-15(20(22)26-19(14)13(12)2)10-16(11-24)21(27)25-18-7-5-17(23)6-8-18/h3-9,16H,10H2,1-2H3,(H,25,27)