2-ethenyl-4-[(3-iodanyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oxymethyl]thiophene-3-carboxylic acid

Systemtic Name: 2-ethenyl-4-[(3-iodanyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oxymethyl]thiophene-3-carboxylic acid Openeye Name: 4-[(7-iodo-1,1,4,4-tetramethyl-tetralin-6-yl)oxymethyl]-2-vinyl-thiophene-3-carboxylic acid CAS Name: 2-ethenyl-4-[(3-iodo-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oxymethyl]-3-thiophenecarboxylic acid IUPAC Name: 2-ethenyl-4-[(3-iodo-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)oxymethyl]thiophene-3-carboxylic acid Traditional Name: 4-[(7-iodo-1,1,4,4-tetramethyl-tetralin-6-yl)oxymethyl]-2-vinyl-3-thenoic acid Formula: C22H25IO3S MolecularWeight: 496.40157

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=CC(=C(C=C21)OCC3=CSC(=C3C(=O)O)C=C)I)(C)C)C

Isomeric SMILES

CC1(CCC(C2=CC(=C(C=C21)OCC3=CSC(=C3C(=O)O)C=C)I)(C)C)C

InChI

InChI=1S/C22H25IO3S/c1-6-18-19(20(24)25)13(12-27-18)11-26-17-10-15-14(9-16(17)23)21(2,3)7-8-22(15,4)5/h6,9-10,12H,1,7-8,11H2,2-5H3,(H,24,25)