(E,4R,5R)-N-(2-aminophenyl)-5-(5-iodanyl-2-oxidanyl-phenyl)-4-methyl-5-oxidanyl-pent-2-enamide

Systemtic Name: (E,4R,5R)-N-(2-aminophenyl)-5-(5-iodanyl-2-oxidanyl-phenyl)-4-methyl-5-oxidanyl-pent-2-enamide Openeye Name: (E,4R,5R)-N-(2-aminophenyl)-5-hydroxy-5-(2-hydroxy-5-iodo-phenyl)-4-methyl-pent-2-enamide CAS Name: (E,4R,5R)-N-(2-aminophenyl)-5-hydroxy-5-(2-hydroxy-5-iodophenyl)-4-methyl-2-pentenamide IUPAC Name: (E,4R,5R)-N-(2-aminophenyl)-5-hydroxy-5-(2-hydroxy-5-iodophenyl)-4-methylpent-2-enamide Traditional Name: (E,4R,5R)-N-(2-aminophenyl)-5-hydroxy-5-(2-hydroxy-5-iodo-phenyl)-4-methyl-pent-2-enamide Formula: C18H19IN2O3 MolecularWeight: 438.25953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C=CC(=O)NC1=CC=CC=C1N)C(C2=C(C=CC(=C2)I)O)O

Isomeric SMILES

C[C@H](/C=C/C(=O)NC1=CC=CC=C1N)[C@H](C2=C(C=CC(=C2)I)O)O

InChI

InChI=1S/C18H19IN2O3/c1-11(18(24)13-10-12(19)7-8-16(13)22)6-9-17(23)21-15-5-3-2-4-14(15)20/h2-11,18,22,24H,20H2,1H3,(H,21,23)/b9-6+/t11-,18-/m1/s1