(E)-3-(2-chloranyl-7-methyl-quinolin-3-yl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide

Systemtic Name: (E)-3-(2-chloranyl-7-methyl-quinolin-3-yl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Openeye Name: (E)-3-(2-chloro-7-methyl-3-quinolyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide CAS Name: (E)-3-(2-chloro-7-methyl-3-quinolinyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]-2-propenamide IUPAC Name: (E)-3-(2-chloro-7-methylquinolin-3-yl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]prop-2-enamide Traditional Name: (E)-3-(2-chloro-7-methyl-3-quinolyl)-2-cyano-N-[(1S,2S)-2-methylcyclohexyl]acrylamide Formula: C21H22ClN3O MolecularWeight: 367.87188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O/c1-13-7-8-15-10-16(20(22)24-19(15)9-13)11-17(12-23)21(26)25-18-6-4-3-5-14(18)2/h7-11,14,18H,3-6H2,1-2H3,(H,25,26)/b17-11+/t14-,18-/m0/s1