2-[6-[(3-chloranylthiophen-2-yl)methoxy]hexyl]-3-ethyl-oxirane-2-carboxylic acid

Systemtic Name: 2-[6-[(3-chloranylthiophen-2-yl)methoxy]hexyl]-3-ethyl-oxirane-2-carboxylic acid Openeye Name: 2-[6-[(3-chloro-2-thienyl)methoxy]hexyl]-3-ethyl-oxirane-2-carboxylic acid CAS Name: 2-[6-[(3-chloro-2-thiophenyl)methoxy]hexyl]-3-ethyl-2-oxiranecarboxylic acid IUPAC Name: 2-[6-[(3-chlorothiophen-2-yl)methoxy]hexyl]-3-ethyloxirane-2-carboxylic acid Traditional Name: 2-[6-[(3-chloro-2-thienyl)methoxy]hexyl]-3-ethyl-oxirane-2-carboxylic acid Formula: C16H23ClO4S MolecularWeight: 346.86942

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(O1)(CCCCCCOCC2=C(C=CS2)Cl)C(=O)O

Isomeric SMILES

CCC1C(O1)(CCCCCCOCC2=C(C=CS2)Cl)C(=O)O

InChI

InChI=1S/C16H23ClO4S/c1-2-14-16(21-14,15(18)19)8-5-3-4-6-9-20-11-13-12(17)7-10-22-13/h7,10,14H,2-6,8-9,11H2,1H3,(H,18,19)