methyl (3Z,5E)-3-azanyl-7-(4-fluoranyl-2-oxidanyl-phenyl)-4-methyl-7-oxidanylidene-6-phenoxysulfonyl-hepta-3,5-dienoate

Systemtic Name: methyl (3Z,5E)-3-azanyl-7-(4-fluoranyl-2-oxidanyl-phenyl)-4-methyl-7-oxidanylidene-6-phenoxysulfonyl-hepta-3,5-dienoate Openeye Name: methyl (3Z,5E)-3-amino-7-(4-fluoro-2-hydroxy-phenyl)-4-methyl-7-oxo-6-phenoxysulfonyl-hepta-3,5-dienoate CAS Name: (3Z,5E)-3-amino-7-(4-fluoro-2-hydroxyphenyl)-4-methyl-7-oxo-6-phenoxysulfonylhepta-3,5-dienoic acid methyl ester IUPAC Name: methyl (3Z,5E)-3-amino-7-(4-fluoro-2-hydroxyphenyl)-4-methyl-7-oxo-6-phenoxysulfonylhepta-3,5-dienoate Traditional Name: (3Z,5E)-3-amino-7-(4-fluoro-2-hydroxy-phenyl)-7-keto-4-methyl-6-phenoxysulfonyl-hepta-3,5-dienoic acid methyl ester Formula: C21H20FNO7S MolecularWeight: 449.449403

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CC(=O)OC)N)C=C(C(=O)C1=C(C=C(C=C1)F)O)S(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

C/C(=C(\CC(=O)OC)/N)/C=C(\C(=O)C1=C(C=C(C=C1)F)O)/S(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C21H20FNO7S/c1-13(17(23)12-20(25)29-2)10-19(21(26)16-9-8-14(22)11-18(16)24)31(27,28)30-15-6-4-3-5-7-15/h3-11,24H,12,23H2,1-2H3/b17-13-,19-10+