(E,5S)-N-(2-aminophenyl)-5-(5-bromanyl-2-oxidanyl-phenyl)-4,4-dimethyl-5-oxidanyl-pent-2-enamide

Systemtic Name: (E,5S)-N-(2-aminophenyl)-5-(5-bromanyl-2-oxidanyl-phenyl)-4,4-dimethyl-5-oxidanyl-pent-2-enamide Openeye Name: (E,5S)-N-(2-aminophenyl)-5-(5-bromo-2-hydroxy-phenyl)-5-hydroxy-4,4-dimethyl-pent-2-enamide CAS Name: (E,5S)-N-(2-aminophenyl)-5-(5-bromo-2-hydroxyphenyl)-5-hydroxy-4,4-dimethyl-2-pentenamide IUPAC Name: (E,5S)-N-(2-aminophenyl)-5-(5-bromo-2-hydroxyphenyl)-5-hydroxy-4,4-dimethylpent-2-enamide Traditional Name: (E,5S)-N-(2-aminophenyl)-5-(5-bromo-2-hydroxy-phenyl)-5-hydroxy-4,4-dimethyl-pent-2-enamide Formula: C19H21BrN2O3 MolecularWeight: 405.28564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2O3/c1-19(2,18(25)13-11-12(20)7-8-16(13)23)10-9-17(24)22-15-6-4-3-5-14(15)21/h3-11,18,23,25H,21H2,1-2H3,(H,22,24)/b10-9+/t18-/m1/s1