(E)-3-(2-chloranyl-8-methyl-quinolin-3-yl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile

Systemtic Name: (E)-3-(2-chloranyl-8-methyl-quinolin-3-yl)-2-(4-fluorophenyl)carbonyl-prop-2-enenitrile Openeye Name: (E)-3-(2-chloro-8-methyl-3-quinolyl)-2-(4-fluorobenzoyl)prop-2-enenitrile CAS Name: (E)-3-(2-chloro-8-methyl-3-quinolinyl)-2-[(4-fluorophenyl)-oxomethyl]-2-propenenitrile IUPAC Name: (E)-3-(2-chloro-8-methylquinolin-3-yl)-2-(4-fluorobenzoyl)prop-2-enenitrile Traditional Name: (E)-3-(2-chloro-8-methyl-3-quinolyl)-2-(4-fluorobenzoyl)acrylonitrile Formula: C20H12ClFN2O MolecularWeight: 350.773483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=CC(=C(N=C12)Cl)C=C(C#N)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=CC2=CC(=C(N=C12)Cl)/C=C(\C#N)/C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C20H12ClFN2O/c1-12-3-2-4-14-9-15(20(21)24-18(12)14)10-16(11-23)19(25)13-5-7-17(22)8-6-13/h2-10H,1H3/b16-10+