6-bromanyl-2-(4-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinoline-4-carboxamide Openeye Name: 6-bromo-2-(4-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(4-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)quinoline-4-carboxamide Traditional Name: 6-bromo-2-(4-butylphenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)cinchoninamide Formula: C28H25BrN2O3 MolecularWeight: 517.4137

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC5=C(C=C4)OCCO5

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4=CC5=C(C=C4)OCCO5

InChI

InChI=1S/C28H25BrN2O3/c1-2-3-4-18-5-7-19(8-6-18)25-17-23(22-15-20(29)9-11-24(22)31-25)28(32)30-21-10-12-26-27(16-21)34-14-13-33-26/h5-12,15-17H,2-4,13-14H2,1H3,(H,30,32)