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

Systemtic Name: 2-[5-aminocarbonyl-9-[(3-cyanophenyl)methyl]-3-fluoranyl-carbazol-4-yl]oxyethanoic acid Openeye Name: 2-[5-carbamoyl-9-[(3-cyanophenyl)methyl]-3-fluoro-carbazol-4-yl]oxyacetic acid CAS Name: 2-[[5-carbamoyl-9-[(3-cyanophenyl)methyl]-3-fluoro-4-carbazolyl]oxy]acetic acid IUPAC Name: 2-[5-carbamoyl-9-[(3-cyanophenyl)methyl]-3-fluorocarbazol-4-yl]oxyacetic acid Traditional Name: 2-[5-carbamoyl-9-(3-cyanobenzyl)-3-fluoro-carbazol-4-yl]oxyacetic acid Formula: C23H16FN3O4 MolecularWeight: 417.389243

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H16FN3O4/c24-16-7-8-18-21(22(16)31-12-19(28)29)20-15(23(26)30)5-2-6-17(20)27(18)11-14-4-1-3-13(9-14)10-25/h1-9H,11-12H2,(H2,26,30)(H,28,29)