(E,6S,7S)-N-(2-aminophenyl)-6-ethoxy-7-(3-fluoranyl-4-oxidanyl-phenyl)-7-oxidanyl-hept-2-enamide

Systemtic Name: (E,6S,7S)-N-(2-aminophenyl)-6-ethoxy-7-(3-fluoranyl-4-oxidanyl-phenyl)-7-oxidanyl-hept-2-enamide Openeye Name: (E,6S,7S)-N-(2-aminophenyl)-6-ethoxy-7-(3-fluoro-4-hydroxy-phenyl)-7-hydroxy-hept-2-enamide CAS Name: (E,6S,7S)-N-(2-aminophenyl)-6-ethoxy-7-(3-fluoro-4-hydroxyphenyl)-7-hydroxy-2-heptenamide IUPAC Name: (E,6S,7S)-N-(2-aminophenyl)-6-ethoxy-7-(3-fluoro-4-hydroxyphenyl)-7-hydroxyhept-2-enamide Traditional Name: (E,6S,7S)-N-(2-aminophenyl)-6-ethoxy-7-(3-fluoro-4-hydroxy-phenyl)-7-hydroxy-hept-2-enamide Formula: C21H25FN2O4 MolecularWeight: 388.432603

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CCC=CC(=O)NC1=CC=CC=C1N)C(C2=CC(=C(C=C2)O)F)O

Isomeric SMILES

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

InChI

InChI=1S/C21H25FN2O4/c1-2-28-19(21(27)14-11-12-18(25)15(22)13-14)9-5-6-10-20(26)24-17-8-4-3-7-16(17)23/h3-4,6-8,10-13,19,21,25,27H,2,5,9,23H2,1H3,(H,24,26)/b10-6+/t19-,21-/m0/s1