3-[(5-methylfuran-2-yl)methylamino]-3-thiophen-2-yl-propanoic acid

Systemtic Name: 3-[(5-methylfuran-2-yl)methylamino]-3-thiophen-2-yl-propanoic acid Openeye Name: 3-[(5-methyl-2-furyl)methylamino]-3-(2-thienyl)propanoic acid CAS Name: 3-[(5-methyl-2-furanyl)methylamino]-3-thiophen-2-ylpropanoic acid IUPAC Name: 3-[(5-methylfuran-2-yl)methylamino]-3-thiophen-2-ylpropanoic acid Traditional Name: 3-[(5-methyl-2-furyl)methylamino]-3-(2-thienyl)propionic acid Formula: C13H15NO3S MolecularWeight: 265.3281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC(CC(=O)O)C2=CC=CS2

Isomeric SMILES

CC1=CC=C(O1)CNC(CC(=O)O)C2=CC=CS2

InChI

InChI=1S/C13H15NO3S/c1-9-4-5-10(17-9)8-14-11(7-13(15)16)12-3-2-6-18-12/h2-6,11,14H,7-8H2,1H3,(H,15,16)