6-bromanyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Openeye Name: 6-bromo-N-[2-(cyclopropylamino)-2-oxo-ethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-N-[2-(cyclopropylamino)-2-oxoethyl]-2-(4-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-N-[2-(cyclopropylamino)-2-oxoethyl]-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 6-bromo-N-[2-(cyclopropylamino)-2-keto-ethyl]-2-(4-methoxyphenyl)cinchoninamide Formula: C22H20BrN3O3 MolecularWeight: 454.3165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC(=O)NC4CC4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NCC(=O)NC4CC4

InChI

InChI=1S/C22H20BrN3O3/c1-29-16-7-2-13(3-8-16)20-11-18(17-10-14(23)4-9-19(17)26-20)22(28)24-12-21(27)25-15-5-6-15/h2-4,7-11,15H,5-6,12H2,1H3,(H,24,28)(H,25,27)