N-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-2-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: N-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-2-cyclopropyl-quinoline-4-carboxamide Openeye Name: N-[(E)-(5-bromo-2-methoxy-phenyl)methyleneamino]-2-cyclopropyl-quinoline-4-carboxamide CAS Name: N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-cyclopropyl-4-quinolinecarboxamide IUPAC Name: N-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-2-cyclopropylquinoline-4-carboxamide Traditional Name: N-[(E)-(5-bromo-2-methoxy-benzylidene)amino]-2-cyclopropyl-cinchoninamide Formula: C21H18BrN3O2 MolecularWeight: 424.29052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C=NNC(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)Br)/C=N/NC(=O)C2=CC(=NC3=CC=CC=C32)C4CC4

InChI

InChI=1S/C21H18BrN3O2/c1-27-20-9-8-15(22)10-14(20)12-23-25-21(26)17-11-19(13-6-7-13)24-18-5-3-2-4-16(17)18/h2-5,8-13H,6-7H2,1H3,(H,25,26)/b23-12+