3-[3-(3-bromanylphenoxy)propanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[3-(3-bromanylphenoxy)propanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-[3-(3-bromophenoxy)propanoylamino]thiophene-2-carboxylic acid CAS Name: 3-[[3-(3-bromophenoxy)-1-oxopropyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[3-(3-bromophenoxy)propanoylamino]thiophene-2-carboxylic acid Traditional Name: 3-[3-(3-bromophenoxy)propanoylamino]-2-thenoic acid Formula: C14H12BrNO4S MolecularWeight: 370.21838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)OCCC(=O)NC2=C(SC=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)Br)OCCC(=O)NC2=C(SC=C2)C(=O)O

InChI

InChI=1S/C14H12BrNO4S/c15-9-2-1-3-10(8-9)20-6-4-12(17)16-11-5-7-21-13(11)14(18)19/h1-3,5,7-8H,4,6H2,(H,16,17)(H,18,19)