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

Systemtic Name: 2-[5-aminocarbonyl-2-(4-chlorophenyl)-9-[(2-cyanophenyl)methyl]carbazol-4-yl]oxyethanoic acid Openeye Name: 2-[5-carbamoyl-2-(4-chlorophenyl)-9-[(2-cyanophenyl)methyl]carbazol-4-yl]oxyacetic acid CAS Name: 2-[[5-carbamoyl-2-(4-chlorophenyl)-9-[(2-cyanophenyl)methyl]-4-carbazolyl]oxy]acetic acid IUPAC Name: 2-[5-carbamoyl-2-(4-chlorophenyl)-9-[(2-cyanophenyl)methyl]carbazol-4-yl]oxyacetic acid Traditional Name: 2-[5-carbamoyl-2-(4-chlorophenyl)-9-(2-cyanobenzyl)carbazol-4-yl]oxyacetic acid Formula: C29H20ClN3O4 MolecularWeight: 509.9398

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C3=CC=CC(=C3C4=C2C=C(C=C4OCC(=O)O)C5=CC=C(C=C5)Cl)C(=O)N)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C3=CC=CC(=C3C4=C2C=C(C=C4OCC(=O)O)C5=CC=C(C=C5)Cl)C(=O)N)C#N

InChI

InChI=1S/C29H20ClN3O4/c30-21-10-8-17(9-11-21)20-12-24-28(25(13-20)37-16-26(34)35)27-22(29(32)36)6-3-7-23(27)33(24)15-19-5-2-1-4-18(19)14-31/h1-13H,15-16H2,(H2,32,36)(H,34,35)