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

Systemtic Name: (E)-3-(2-chloranyl-7-methyl-quinolin-3-yl)-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-(2-chloro-7-methyl-3-quinolyl)-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-3-(2-chloro-7-methyl-3-quinolinyl)-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (E)-3-(2-chloro-7-methylquinolin-3-yl)-2-cyano-N-phenethylprop-2-enamide Traditional Name: (E)-3-(2-chloro-7-methyl-3-quinolyl)-2-cyano-N-phenethyl-acrylamide Formula: C22H18ClN3O MolecularWeight: 375.85082

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=NC(=C(C=C2C=C1)C=C(C#N)C(=O)NCCC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC2=NC(=C(C=C2C=C1)/C=C(\C#N)/C(=O)NCCC3=CC=CC=C3)Cl

InChI

InChI=1S/C22H18ClN3O/c1-15-7-8-17-12-18(21(23)26-20(17)11-15)13-19(14-24)22(27)25-10-9-16-5-3-2-4-6-16/h2-8,11-13H,9-10H2,1H3,(H,25,27)/b19-13+