3-(oxolan-3-ylmethylamino)-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-(oxolan-3-ylmethylamino)-3-thiophen-2-yl-propanoic acid Openeye Name: 3-(tetrahydrofuran-3-ylmethylamino)-3-(2-thienyl)propanoic acid CAS Name: 3-(3-oxolanylmethylamino)-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-(oxolan-3-ylmethylamino)-3-thiophen-2-ylpropanoic acid Traditional Name: 3-(tetrahydrofuran-3-ylmethylamino)-3-(2-thienyl)propionic acid Formula: C12H17NO3S MolecularWeight: 255.33328

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC1CNC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

C1COCC1CNC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C12H17NO3S/c14-12(15)6-10(11-2-1-5-17-11)13-7-9-3-4-16-8-9/h1-2,5,9-10,13H,3-4,6-8H2,(H,14,15)