4-[2-(3-ethynylphenoxy)ethanoylamino]thiophene-3-carboxylic acid

Systemtic Name: 4-[2-(3-ethynylphenoxy)ethanoylamino]thiophene-3-carboxylic acid Openeye Name: 4-[[2-(3-ethynylphenoxy)acetyl]amino]thiophene-3-carboxylic acid CAS Name: 4-[[2-(3-ethynylphenoxy)-1-oxoethyl]amino]-3-thiophenecarboxylic acid IUPAC Name: 4-[[2-(3-ethynylphenoxy)acetyl]amino]thiophene-3-carboxylic acid Traditional Name: 4-[[2-(3-ethynylphenoxy)acetyl]amino]-3-thenoic acid Formula: C15H11NO4S MolecularWeight: 301.31714

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CC(=CC=C1)OCC(=O)NC2=CSC=C2C(=O)O

Isomeric SMILES

C#CC1=CC(=CC=C1)OCC(=O)NC2=CSC=C2C(=O)O

InChI

InChI=1S/C15H11NO4S/c1-2-10-4-3-5-11(6-10)20-7-14(17)16-13-9-21-8-12(13)15(18)19/h1,3-6,8-9H,7H2,(H,16,17)(H,18,19)