5-(3-aminophenyl)-4-bromanyl-3-(carboxymethyloxy)thiophene-2-carboxylic acid

Systemtic Name: 5-(3-aminophenyl)-4-bromanyl-3-(carboxymethyloxy)thiophene-2-carboxylic acid Openeye Name: 5-(3-aminophenyl)-4-bromo-3-(carboxymethyloxy)thiophene-2-carboxylic acid CAS Name: 5-(3-aminophenyl)-4-bromo-3-(carboxymethyloxy)-2-thiophenecarboxylic acid IUPAC Name: 5-(3-aminophenyl)-4-bromo-3-(carboxymethyloxy)thiophene-2-carboxylic acid Traditional Name: 5-(3-aminophenyl)-4-bromo-3-(carboxymethyloxy)-2-thenoic acid Formula: C13H10BrNO5S MolecularWeight: 372.1912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)C2=C(C(=C(S2)C(=O)O)OCC(=O)O)Br

Isomeric SMILES

C1=CC(=CC(=C1)N)C2=C(C(=C(S2)C(=O)O)OCC(=O)O)Br

InChI

InChI=1S/C13H10BrNO5S/c14-9-10(20-5-8(16)17)12(13(18)19)21-11(9)6-2-1-3-7(15)4-6/h1-4H,5,15H2,(H,16,17)(H,18,19)