ethyl 2-[(3S,4R,5S)-5-(2-chlorophenyl)-4-methanoyl-thiolan-3-yl]ethanoate

Systemtic Name: ethyl 2-[(3S,4R,5S)-5-(2-chlorophenyl)-4-methanoyl-thiolan-3-yl]ethanoate Openeye Name: ethyl 2-[(3S,4R,5S)-5-(2-chlorophenyl)-4-formyl-tetrahydrothiophen-3-yl]acetate CAS Name: 2-[(3S,4R,5S)-5-(2-chlorophenyl)-4-formyl-3-thiolanyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(3S,4R,5S)-5-(2-chlorophenyl)-4-formylthiolan-3-yl]acetate Traditional Name: 2-[(3S,4R,5S)-5-(2-chlorophenyl)-4-formyl-tetrahydrothiophen-3-yl]acetic acid ethyl ester Formula: C15H17ClO3S MolecularWeight: 312.81168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CSC(C1C=O)C2=CC=CC=C2Cl

Isomeric SMILES

CCOC(=O)C[C@@H]1CS[C@@H]([C@H]1C=O)C2=CC=CC=C2Cl

InChI

InChI=1S/C15H17ClO3S/c1-2-19-14(18)7-10-9-20-15(12(10)8-17)11-5-3-4-6-13(11)16/h3-6,8,10,12,15H,2,7,9H2,1H3/t10-,12+,15-/m1/s1