methyl (E,4R,5S)-7-(2-ethanoyl-1,3-thiazol-4-yl)-5-methoxy-4-methyl-3-oxidanylidene-hept-6-enoate

Systemtic Name: methyl (E,4R,5S)-7-(2-ethanoyl-1,3-thiazol-4-yl)-5-methoxy-4-methyl-3-oxidanylidene-hept-6-enoate Openeye Name: methyl (E,4R,5S)-7-(2-acetylthiazol-4-yl)-5-methoxy-4-methyl-3-oxo-hept-6-enoate CAS Name: (E,4R,5S)-7-(2-acetyl-4-thiazolyl)-5-methoxy-4-methyl-3-oxo-6-heptenoic acid methyl ester IUPAC Name: methyl (E,4R,5S)-7-(2-acetyl-1,3-thiazol-4-yl)-5-methoxy-4-methyl-3-oxohept-6-enoate Traditional Name: (E,4R,5S)-7-(2-acetylthiazol-4-yl)-3-keto-5-methoxy-4-methyl-hept-6-enoic acid methyl ester Formula: C15H19NO5S MolecularWeight: 325.38006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C=CC1=CSC(=N1)C(=O)C)OC)C(=O)CC(=O)OC

Isomeric SMILES

C[C@H]([C@H](/C=C/C1=CSC(=N1)C(=O)C)OC)C(=O)CC(=O)OC

InChI

InChI=1S/C15H19NO5S/c1-9(12(18)7-14(19)21-4)13(20-3)6-5-11-8-22-15(16-11)10(2)17/h5-6,8-9,13H,7H2,1-4H3/b6-5+/t9-,13-/m0/s1