3-[(6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl)amino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[(6-oxidanyl-2,3-dihydro-1-benzofuran-3-yl)amino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[(6-hydroxy-2,3-dihydrobenzofuran-3-yl)amino]-3-(2-thienyl)propanoic acid CAS Name: 3-[(6-hydroxy-2,3-dihydrobenzofuran-3-yl)amino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[(6-hydroxy-2,3-dihydro-1-benzofuran-3-yl)amino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[(6-hydroxycoumaran-3-yl)amino]-3-(2-thienyl)propionic acid Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C2=C(O1)C=C(C=C2)O)NC(CC(=O)O)C3=CC=CS3

Isomeric SMILES

C1C(C2=C(O1)C=C(C=C2)O)NC(CC(=O)O)C3=CC=CS3

InChI

InChI=1S/C15H15NO4S/c17-9-3-4-10-12(8-20-13(10)6-9)16-11(7-15(18)19)14-2-1-5-21-14/h1-6,11-12,16-17H,7-8H2,(H,18,19)