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5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydro-1-benzofuran-7-carboxylic acid

Systemtic Name:5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydro-1-benzofuran-7-carboxylic acid
Openeye Name:5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydrobenzofuran-7-carboxylic acid
CAS Name:5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydrobenzofuran-7-carboxylic acid
IUPAC Name:5-(cyclopropylmethylsulfonyl)-2-methyl-2,3-dihydro-1-benzofuran-7-carboxylic acid
Traditional Name:5-(cyclopropylmethylsulfonyl)-2-methyl-coumaran-7-carboxylic acid
Formula: C14H16O5S
MolecularWeight: 296.33884
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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(O1)C(=CC(=C2)S(=O)(=O)CC3CC3)C(=O)O


Isomeric SMILES

CC1CC2=C(O1)C(=CC(=C2)S(=O)(=O)CC3CC3)C(=O)O


InChI

InChI=1S/C14H16O5S/c1-8-4-10-5-11(20(17,18)7-9-2-3-9)6-12(14(15)16)13(10)19-8/h5-6,8-9H,2-4,7H2,1H3,(H,15,16)


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