ethyl (4S)-4-[(1S)-2-chloranyl-1-methoxy-ethyl]-3-oxidanylidene-heptanoate

Systemtic Name: ethyl (4S)-4-[(1S)-2-chloranyl-1-methoxy-ethyl]-3-oxidanylidene-heptanoate Openeye Name: ethyl (4S)-4-[(1S)-2-chloro-1-methoxy-ethyl]-3-oxo-heptanoate CAS Name: (4S)-4-[(1S)-2-chloro-1-methoxyethyl]-3-oxoheptanoic acid ethyl ester IUPAC Name: ethyl (4S)-4-[(1S)-2-chloro-1-methoxyethyl]-3-oxoheptanoate Traditional Name: (4S)-4-[(1S)-2-chloro-1-methoxy-ethyl]-3-keto-enanthic acid ethyl ester Formula: C12H21ClO4 MolecularWeight: 264.74574

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CCl)OC)C(=O)CC(=O)OCC

Isomeric SMILES

CCC[C@@H]([C@@H](CCl)OC)C(=O)CC(=O)OCC

InChI

InChI=1S/C12H21ClO4/c1-4-6-9(11(8-13)16-3)10(14)7-12(15)17-5-2/h9,11H,4-8H2,1-3H3/t9-,11-/m1/s1