6-bromanyl-N-[(E)-(6-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-2-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[(E)-(6-chloranyl-1,3-benzodioxol-5-yl)methylideneamino]-2-cyclopropyl-quinoline-4-carboxamide Openeye Name: 6-bromo-N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methyleneamino]-2-cyclopropyl-quinoline-4-carboxamide CAS Name: 6-bromo-N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-cyclopropyl-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methylideneamino]-2-cyclopropylquinoline-4-carboxamide Traditional Name: 6-bromo-N-[(E)-(6-chloro-1,3-benzodioxol-5-yl)methyleneamino]-2-cyclopropyl-cinchoninamide Formula: C21H15BrClN3O3 MolecularWeight: 472.7191

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NN=CC4=CC5=C(C=C4Cl)OCO5

Isomeric SMILES

C1CC1C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N/N=C/C4=CC5=C(C=C4Cl)OCO5

InChI

InChI=1S/C21H15BrClN3O3/c22-13-3-4-17-14(6-13)15(7-18(25-17)11-1-2-11)21(27)26-24-9-12-5-19-20(8-16(12)23)29-10-28-19/h3-9,11H,1-2,10H2,(H,26,27)/b24-9+