2-acetamido-2-(1-benzothiophen-3-yl)propanedioic acid

Systemtic Name: 2-acetamido-2-(1-benzothiophen-3-yl)propanedioic acid Openeye Name: 2-acetamido-2-(benzothiophen-3-yl)propanedioic acid CAS Name: 2-acetamido-2-(1-benzothiophen-3-yl)propanedioic acid IUPAC Name: 2-acetamido-2-(1-benzothiophen-3-yl)propanedioic acid Traditional Name: 2-acetamido-2-(benzothiophen-3-yl)malonic acid Formula: C13H11NO5S MolecularWeight: 293.29514

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C1=CSC2=CC=CC=C21)(C(=O)O)C(=O)O

Isomeric SMILES

CC(=O)NC(C1=CSC2=CC=CC=C21)(C(=O)O)C(=O)O

InChI

InChI=1S/C13H11NO5S/c1-7(15)14-13(11(16)17,12(18)19)9-6-20-10-5-3-2-4-8(9)10/h2-6H,1H3,(H,14,15)(H,16,17)(H,18,19)