(E)-4-bromanyl-N-[4-[(3-bromanyl-4-fluoranyl-phenyl)amino]-3-cyano-7-methoxy-quinolin-6-yl]but-2-enamide

Systemtic Name: (E)-4-bromanyl-N-[4-[(3-bromanyl-4-fluoranyl-phenyl)amino]-3-cyano-7-methoxy-quinolin-6-yl]but-2-enamide Openeye Name: (E)-4-bromo-N-[4-(3-bromo-4-fluoro-anilino)-3-cyano-7-methoxy-6-quinolyl]but-2-enamide CAS Name: (E)-4-bromo-N-[4-(3-bromo-4-fluoroanilino)-3-cyano-7-methoxy-6-quinolinyl]-2-butenamide IUPAC Name: (E)-4-bromo-N-[4-(3-bromo-4-fluoroanilino)-3-cyano-7-methoxyquinolin-6-yl]but-2-enamide Traditional Name: (E)-4-bromo-N-[4-(3-bromo-4-fluoro-anilino)-3-cyano-7-methoxy-6-quinolyl]but-2-enamide Formula: C21H15Br2FN4O2 MolecularWeight: 534.175803

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)F)Br)C#N)NC(=O)C=CCBr

Isomeric SMILES

COC1=C(C=C2C(=C1)N=CC(=C2NC3=CC(=C(C=C3)F)Br)C#N)NC(=O)/C=C/CBr

InChI

InChI=1S/C21H15Br2FN4O2/c1-30-19-9-17-14(8-18(19)28-20(29)3-2-6-22)21(12(10-25)11-26-17)27-13-4-5-16(24)15(23)7-13/h2-5,7-9,11H,6H2,1H3,(H,26,27)(H,28,29)/b3-2+