(E)-3-(2-chloranyl-6-methoxy-quinolin-3-yl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide

Systemtic Name: (E)-3-(2-chloranyl-6-methoxy-quinolin-3-yl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Openeye Name: (E)-3-(2-chloro-6-methoxy-3-quinolyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide CAS Name: (E)-3-(2-chloro-6-methoxy-3-quinolinyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-2-propenamide IUPAC Name: (E)-3-(2-chloro-6-methoxyquinolin-3-yl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Traditional Name: (E)-3-(2-chloro-6-methoxy-3-quinolyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]acrylamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C(=CC2=C(N=C3C=CC(=CC3=C2)OC)Cl)C#N

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)/C(=C/C2=C(N=C3C=CC(=CC3=C2)OC)Cl)/C#N

InChI

InChI=1S/C21H22ClN3O2/c1-13-5-3-4-6-18(13)25-21(26)16(12-23)10-15-9-14-11-17(27-2)7-8-19(14)24-20(15)22/h7-11,13,18H,3-6H2,1-2H3,(H,25,26)/b16-10+/t13-,18-/m0/s1