ethyl (3S)-7-chloranyl-3-oxidanyl-5-oxidanylidene-heptanoate

Systemtic Name: ethyl (3S)-7-chloranyl-3-oxidanyl-5-oxidanylidene-heptanoate Openeye Name: ethyl (3S)-7-chloro-3-hydroxy-5-oxo-heptanoate CAS Name: (3S)-7-chloro-3-hydroxy-5-oxoheptanoic acid ethyl ester IUPAC Name: ethyl (3S)-7-chloro-3-hydroxy-5-oxoheptanoate Traditional Name: (3S)-7-chloro-3-hydroxy-5-keto-enanthic acid ethyl ester Formula: C9H15ClO4 MolecularWeight: 222.666

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC(=O)CCCl)O

Isomeric SMILES

CCOC(=O)C[C@H](CC(=O)CCCl)O

InChI

InChI=1S/C9H15ClO4/c1-2-14-9(13)6-8(12)5-7(11)3-4-10/h8,12H,2-6H2,1H3/t8-/m0/s1