2-[5-aminocarbonyl-9-[(3-bromophenyl)methyl]-3-fluoranyl-carbazol-4-yl]oxyethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(3-bromophenyl)methyl]-3-fluoranyl-carbazol-4-yl]oxyethanoic acid Openeye Name: 2-[9-[(3-bromophenyl)methyl]-5-carbamoyl-3-fluoro-carbazol-4-yl]oxyacetic acid CAS Name: 2-[[9-[(3-bromophenyl)methyl]-5-carbamoyl-3-fluoro-4-carbazolyl]oxy]acetic acid IUPAC Name: 2-[9-[(3-bromophenyl)methyl]-5-carbamoyl-3-fluorocarbazol-4-yl]oxyacetic acid Traditional Name: 2-[9-(3-bromobenzyl)-5-carbamoyl-3-fluoro-carbazol-4-yl]oxyacetic acid Formula: C22H16BrFN2O4 MolecularWeight: 471.275843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CN2C3=C(C4=C(C=CC=C42)C(=O)N)C(=C(C=C3)F)OCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)CN2C3=C(C4=C(C=CC=C42)C(=O)N)C(=C(C=C3)F)OCC(=O)O

InChI

InChI=1S/C22H16BrFN2O4/c23-13-4-1-3-12(9-13)10-26-16-6-2-5-14(22(25)29)19(16)20-17(26)8-7-15(24)21(20)30-11-18(27)28/h1-9H,10-11H2,(H2,25,29)(H,27,28)