[5,7-bis(bromanyl)quinolin-8-yl] 4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate

Systemtic Name: [5,7-bis(bromanyl)quinolin-8-yl] 4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate Openeye Name: (5,7-dibromo-8-quinolyl) 4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butanoate CAS Name: 4-[5-methyl-2-(2-pyridinyl)-1H-indol-3-yl]butanoic acid (5,7-dibromo-8-quinolinyl) ester IUPAC Name: (5,7-dibromoquinolin-8-yl) 4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butanoate Traditional Name: 4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butyric acid (5,7-dibromo-8-quinolyl) ester Formula: C27H21Br2N3O2 MolecularWeight: 579.28254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)OC3=C(C=C(C4=C3N=CC=C4)Br)Br)C5=CC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)OC3=C(C=C(C4=C3N=CC=C4)Br)Br)C5=CC=CC=N5

InChI

InChI=1S/C27H21Br2N3O2/c1-16-10-11-22-19(14-16)17(25(32-22)23-8-2-3-12-30-23)6-4-9-24(33)34-27-21(29)15-20(28)18-7-5-13-31-26(18)27/h2-3,5,7-8,10-15,32H,4,6,9H2,1H3