methyl 2-[(1S)-2-methyl-1-[(2R,3S)-2-methyl-3-oxidanyl-octanoyl]oxy-propyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[(1S)-2-methyl-1-[(2R,3S)-2-methyl-3-oxidanyl-octanoyl]oxy-propyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[(1S)-1-[(2R,3S)-3-hydroxy-2-methyl-octanoyl]oxy-2-methyl-propyl]thiazole-4-carboxylate CAS Name: 2-[(1S)-1-[(2R,3S)-3-hydroxy-2-methyl-1-oxooctoxy]-2-methylpropyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[(1S)-1-[(2R,3S)-3-hydroxy-2-methyloctanoyl]oxy-2-methylpropyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[(1S)-1-[(2R,3S)-3-hydroxy-2-methyl-octanoyl]oxy-2-methyl-propyl]thiazole-4-carboxylic acid methyl ester Formula: C18H29NO5S MolecularWeight: 371.49156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(C)C(=O)OC(C1=NC(=CS1)C(=O)OC)C(C)C)O

Isomeric SMILES

CCCCC[C@@H]([C@@H](C)C(=O)O[C@H](C1=NC(=CS1)C(=O)OC)C(C)C)O

InChI

InChI=1S/C18H29NO5S/c1-6-7-8-9-14(20)12(4)17(21)24-15(11(2)3)16-19-13(10-25-16)18(22)23-5/h10-12,14-15,20H,6-9H2,1-5H3/t12-,14+,15+/m1/s1