2-[5-aminocarbonyl-9-[(4-bromanyl-2-fluoranyl-phenyl)methyl]carbazol-4-yl]oxy-2-(4-methoxyphenyl)ethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(4-bromanyl-2-fluoranyl-phenyl)methyl]carbazol-4-yl]oxy-2-(4-methoxyphenyl)ethanoic acid Openeye Name: 2-[9-[(4-bromo-2-fluoro-phenyl)methyl]-5-carbamoyl-carbazol-4-yl]oxy-2-(4-methoxyphenyl)acetic acid CAS Name: 2-[[9-[(4-bromo-2-fluorophenyl)methyl]-5-carbamoyl-4-carbazolyl]oxy]-2-(4-methoxyphenyl)acetic acid IUPAC Name: 2-[9-[(4-bromo-2-fluorophenyl)methyl]-5-carbamoylcarbazol-4-yl]oxy-2-(4-methoxyphenyl)acetic acid Traditional Name: 2-[9-(4-bromo-2-fluoro-benzyl)-5-carbamoyl-carbazol-4-yl]oxy-2-(4-methoxyphenyl)acetic acid Formula: C29H22BrFN2O5 MolecularWeight: 577.397783

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C(=O)O)OC2=CC=CC3=C2C4=C(C=CC=C4N3CC5=C(C=C(C=C5)Br)F)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(C(=O)O)OC2=CC=CC3=C2C4=C(C=CC=C4N3CC5=C(C=C(C=C5)Br)F)C(=O)N

InChI

InChI=1S/C29H22BrFN2O5/c1-37-19-12-9-16(10-13-19)27(29(35)36)38-24-7-3-6-23-26(24)25-20(28(32)34)4-2-5-22(25)33(23)15-17-8-11-18(30)14-21(17)31/h2-14,27H,15H2,1H3,(H2,32,34)(H,35,36)