3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxylic acid Openeye Name: 3-methyl-5-(1-piperidylsulfonyl)benzofuran-2-carboxylic acid CAS Name: 3-methyl-5-(1-piperidinylsulfonyl)-2-benzofurancarboxylic acid IUPAC Name: 3-methyl-5-piperidin-1-ylsulfonyl-1-benzofuran-2-carboxylic acid Traditional Name: 3-methyl-5-piperidinosulfonyl-coumarilic acid Formula: C15H17NO5S MolecularWeight: 323.36418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)O

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCCC3)C(=O)O

InChI

InChI=1S/C15H17NO5S/c1-10-12-9-11(5-6-13(12)21-14(10)15(17)18)22(19,20)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8H2,1H3,(H,17,18)