3-[[methyl(thiolan-3-yl)amino]methyl]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[[methyl(thiolan-3-yl)amino]methyl]-1-benzofuran-2-carboxylic acid Openeye Name: 3-[[methyl(tetrahydrothiophen-3-yl)amino]methyl]benzofuran-2-carboxylic acid CAS Name: 3-[[methyl(3-thiolanyl)amino]methyl]-2-benzofurancarboxylic acid IUPAC Name: 3-[[methyl(thiolan-3-yl)amino]methyl]-1-benzofuran-2-carboxylic acid Traditional Name: 3-[[methyl(tetrahydrothiophen-3-yl)amino]methyl]coumarilic acid Formula: C15H17NO3S MolecularWeight: 291.36538

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(OC2=CC=CC=C21)C(=O)O)C3CCSC3

Isomeric SMILES

CN(CC1=C(OC2=CC=CC=C21)C(=O)O)C3CCSC3

InChI

InChI=1S/C15H17NO3S/c1-16(10-6-7-20-9-10)8-12-11-4-2-3-5-13(11)19-14(12)15(17)18/h2-5,10H,6-9H2,1H3,(H,17,18)