2-[3-(2-azanylethylamino)-1-thiophen-3-yl-propoxy]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[3-(2-azanylethylamino)-1-thiophen-3-yl-propoxy]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[3-(2-aminoethylamino)-1-(3-thienyl)propoxy]-2-oxo-acetic acid CAS Name: 2-[3-(2-aminoethylamino)-1-(3-thiophenyl)propoxy]-2-oxoacetic acid IUPAC Name: 2-[3-(2-aminoethylamino)-1-thiophen-3-ylpropoxy]-2-oxoacetic acid Traditional Name: 2-[3-(2-aminoethylamino)-1-(3-thienyl)propoxy]-2-keto-acetic acid Formula: C11H16N2O4S MolecularWeight: 272.32074

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C(CCNCCN)OC(=O)C(=O)O

Isomeric SMILES

C1=CSC=C1C(CCNCCN)OC(=O)C(=O)O

InChI

InChI=1S/C11H16N2O4S/c12-3-5-13-4-1-9(8-2-6-18-7-8)17-11(16)10(14)15/h2,6-7,9,13H,1,3-5,12H2,(H,14,15)