2-[5-aminocarbonyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-2-thiophen-2-yl-ethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-2-thiophen-2-yl-ethanoic acid Openeye Name: 2-[5-carbamoyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-2-(2-thienyl)acetic acid CAS Name: 2-[[5-carbamoyl-9-[(4-iodophenyl)methyl]-4-carbazolyl]oxy]-2-thiophen-2-ylacetic acid IUPAC Name: 2-[5-carbamoyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-2-thiophen-2-ylacetic acid Traditional Name: 2-[5-carbamoyl-9-(4-iodobenzyl)carbazol-4-yl]oxy-2-(2-thienyl)acetic acid Formula: C26H19IN2O4S MolecularWeight: 582.40953

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(C4=CC=CS4)C(=O)O)CC5=CC=C(C=C5)I)C(=O)N

Isomeric SMILES

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(C4=CC=CS4)C(=O)O)CC5=CC=C(C=C5)I)C(=O)N

InChI

InChI=1S/C26H19IN2O4S/c27-16-11-9-15(10-12-16)14-29-18-5-1-4-17(25(28)30)22(18)23-19(29)6-2-7-20(23)33-24(26(31)32)21-8-3-13-34-21/h1-13,24H,14H2,(H2,28,30)(H,31,32)