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

Systemtic Name: [1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Openeye Name: [2-(4-bromo-2-fluoro-anilino)-1-methyl-2-oxo-ethyl] 2,3-bis(p-tolyl)quinoxaline-6-carboxylate CAS Name: 2,3-bis(4-methylphenyl)-6-quinoxalinecarboxylic acid [1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-bromo-2-fluoroanilino)-1-oxopropan-2-yl] 2,3-bis(4-methylphenyl)quinoxaline-6-carboxylate Traditional Name: 2,3-bis(p-tolyl)quinoxaline-6-carboxylic acid [2-(4-bromo-2-fluoro-anilino)-2-keto-1-methyl-ethyl] ester Formula: C32H25BrFN3O3 MolecularWeight: 598.461603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)OC(C)C(=O)NC4=C(C=C(C=C4)Br)F)N=C2C5=CC=C(C=C5)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(=O)OC(C)C(=O)NC4=C(C=C(C=C4)Br)F)N=C2C5=CC=C(C=C5)C

InChI

InChI=1S/C32H25BrFN3O3/c1-18-4-8-21(9-5-18)29-30(22-10-6-19(2)7-11-22)36-28-16-23(12-14-27(28)35-29)32(39)40-20(3)31(38)37-26-15-13-24(33)17-25(26)34/h4-17,20H,1-3H3,(H,37,38)