[1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2,3-bis(4-methoxyphenyl)quinoxaline-6-carboxylate

Systemtic Name: [1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 2,3-bis(4-methoxyphenyl)quinoxaline-6-carboxylate Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]propyl 2,3-bis(4-methoxyphenyl)quinoxaline-6-carboxylate CAS Name: 2,3-bis(4-methoxyphenyl)-6-quinoxalinecarboxylic acid [1-(4-bromo-2-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-bromo-2-fluoroanilino)-1-oxobutan-2-yl] 2,3-bis(4-methoxyphenyl)quinoxaline-6-carboxylate Traditional Name: 2,3-bis(4-methoxyphenyl)quinoxaline-6-carboxylic acid 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]propyl ester Formula: C33H27BrFN3O5 MolecularWeight: 644.486983

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C33H27BrFN3O5/c1-4-29(32(39)38-26-16-10-22(34)18-25(26)35)43-33(40)21-9-15-27-28(17-21)37-31(20-7-13-24(42-3)14-8-20)30(36-27)19-5-11-23(41-2)12-6-19/h5-18,29H,4H2,1-3H3,(H,38,39)