2-[[[3-[(2-methylpropan-2-yl)oxycarbonyl]thiophen-2-yl]amino]methylidene]propanedioic acid

Systemtic Name: 2-[[[3-[(2-methylpropan-2-yl)oxycarbonyl]thiophen-2-yl]amino]methylidene]propanedioic acid Openeye Name: 2-[[(3-tert-butoxycarbonyl-2-thienyl)amino]methylene]propanedioic acid CAS Name: 2-[[[3-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-thiophenyl]amino]methylidene]propanedioic acid IUPAC Name: 2-[[[3-[(2-methylpropan-2-yl)oxycarbonyl]thiophen-2-yl]amino]methylidene]propanedioic acid Traditional Name: 2-[[(3-tert-butoxycarbonyl-2-thienyl)amino]methylene]malonic acid Formula: C13H15NO6S MolecularWeight: 313.3263

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(SC=C1)NC=C(C(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(SC=C1)NC=C(C(=O)O)C(=O)O

InChI

InChI=1S/C13H15NO6S/c1-13(2,3)20-12(19)7-4-5-21-9(7)14-6-8(10(15)16)11(17)18/h4-6,14H,1-3H3,(H,15,16)(H,17,18)