6-bromanyl-2-methyl-N-[(E)-2-[2,3,4-tris(oxidanyl)phenyl]ethylideneamino]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-methyl-N-[(E)-2-[2,3,4-tris(oxidanyl)phenyl]ethylideneamino]quinoline-4-carboxamide Openeye Name: 6-bromo-2-methyl-N-[(E)-2-(2,3,4-trihydroxyphenyl)ethylideneamino]quinoline-4-carboxamide CAS Name: 6-bromo-2-methyl-N-[(E)-2-(2,3,4-trihydroxyphenyl)ethylideneamino]-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-methyl-N-[(E)-2-(2,3,4-trihydroxyphenyl)ethylideneamino]quinoline-4-carboxamide Traditional Name: 6-bromo-2-methyl-N-[(E)-2-(2,3,4-trihydroxyphenyl)ethylideneamino]cinchoninamide Formula: C19H16BrN3O4 MolecularWeight: 430.25204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Br)C(=C1)C(=O)NN=CCC3=C(C(=C(C=C3)O)O)O

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Br)C(=C1)C(=O)N/N=C/CC3=C(C(=C(C=C3)O)O)O

InChI

InChI=1S/C19H16BrN3O4/c1-10-8-14(13-9-12(20)3-4-15(13)22-10)19(27)23-21-7-6-11-2-5-16(24)18(26)17(11)25/h2-5,7-9,24-26H,6H2,1H3,(H,23,27)/b21-7+