(E)-3-(2-chloranyl-7-methyl-quinolin-3-yl)-2-cyano-N-(3-methylphenyl)prop-2-enamide

Systemtic Name: (E)-3-(2-chloranyl-7-methyl-quinolin-3-yl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Openeye Name: (E)-3-(2-chloro-7-methyl-3-quinolyl)-2-cyano-N-(m-tolyl)prop-2-enamide CAS Name: (E)-3-(2-chloro-7-methyl-3-quinolinyl)-2-cyano-N-(3-methylphenyl)-2-propenamide IUPAC Name: (E)-3-(2-chloro-7-methylquinolin-3-yl)-2-cyano-N-(3-methylphenyl)prop-2-enamide Traditional Name: (E)-3-(2-chloro-7-methyl-3-quinolyl)-2-cyano-N-(m-tolyl)acrylamide Formula: C21H16ClN3O MolecularWeight: 361.82424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=CC2=C(N=C3C=C(C=CC3=C2)C)Cl)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)/C(=C/C2=C(N=C3C=C(C=CC3=C2)C)Cl)/C#N

InChI

InChI=1S/C21H16ClN3O/c1-13-4-3-5-18(8-13)24-21(26)17(12-23)11-16-10-15-7-6-14(2)9-19(15)25-20(16)22/h3-11H,1-2H3,(H,24,26)/b17-11+