3-ethyl-2-[6-[(5-methylthiophen-2-yl)methoxy]hexyl]oxirane-2-carboxylic acid

Systemtic Name: 3-ethyl-2-[6-[(5-methylthiophen-2-yl)methoxy]hexyl]oxirane-2-carboxylic acid Openeye Name: 3-ethyl-2-[6-[(5-methyl-2-thienyl)methoxy]hexyl]oxirane-2-carboxylic acid CAS Name: 3-ethyl-2-[6-[(5-methyl-2-thiophenyl)methoxy]hexyl]-2-oxiranecarboxylic acid IUPAC Name: 3-ethyl-2-[6-[(5-methylthiophen-2-yl)methoxy]hexyl]oxirane-2-carboxylic acid Traditional Name: 3-ethyl-2-[6-[(5-methyl-2-thienyl)methoxy]hexyl]oxirane-2-carboxylic acid Formula: C17H26O4S MolecularWeight: 326.45094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(O1)(CCCCCCOCC2=CC=C(S2)C)C(=O)O

Isomeric SMILES

CCC1C(O1)(CCCCCCOCC2=CC=C(S2)C)C(=O)O

InChI

InChI=1S/C17H26O4S/c1-3-15-17(21-15,16(18)19)10-6-4-5-7-11-20-12-14-9-8-13(2)22-14/h8-9,15H,3-7,10-12H2,1-2H3,(H,18,19)