3-methyl-5-pyrrolidin-1-ylsulfonyl-1-benzofuran-2-carboxylate

Systemtic Name: 3-methyl-5-pyrrolidin-1-ylsulfonyl-1-benzofuran-2-carboxylate Openeye Name: 3-methyl-5-pyrrolidin-1-ylsulfonyl-benzofuran-2-carboxylate CAS Name: 3-methyl-5-(1-pyrrolidinylsulfonyl)-2-benzofurancarboxylate IUPAC Name: 3-methyl-5-pyrrolidin-1-ylsulfonyl-1-benzofuran-2-carboxylate Traditional Name: 3-methyl-5-pyrrolidinosulfonyl-coumarilate Formula: C14H14NO5S- MolecularWeight: 308.32966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)[O-]

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)S(=O)(=O)N3CCCC3)C(=O)[O-]

InChI

InChI=1S/C14H15NO5S/c1-9-11-8-10(21(18,19)15-6-2-3-7-15)4-5-12(11)20-13(9)14(16)17/h4-5,8H,2-3,6-7H2,1H3,(H,16,17)/p-1