2-[5-aminocarbonyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-3-oxidanyl-propanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-3-oxidanyl-propanoic acid Openeye Name: 2-[5-carbamoyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-3-hydroxy-propanoic acid CAS Name: 2-[[5-carbamoyl-9-[(4-iodophenyl)methyl]-4-carbazolyl]oxy]-3-hydroxypropanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(4-iodophenyl)methyl]carbazol-4-yl]oxy-3-hydroxypropanoic acid Traditional Name: 2-[5-carbamoyl-9-(4-iodobenzyl)carbazol-4-yl]oxy-3-hydroxy-propionic acid Formula: C23H19IN2O5 MolecularWeight: 530.31183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(CO)C(=O)O)CC4=CC=C(C=C4)I)C(=O)N

Isomeric SMILES

C1=CC(=C2C(=C1)N(C3=C2C(=CC=C3)OC(CO)C(=O)O)CC4=CC=C(C=C4)I)C(=O)N

InChI

InChI=1S/C23H19IN2O5/c24-14-9-7-13(8-10-14)11-26-16-4-1-3-15(22(25)28)20(16)21-17(26)5-2-6-18(21)31-19(12-27)23(29)30/h1-10,19,27H,11-12H2,(H2,25,28)(H,29,30)