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

Systemtic Name: 5-(3-benzamidophenyl)-4-bromanyl-3-(carboxymethyloxy)thiophene-2-carboxylic acid Openeye Name: 5-(3-benzamidophenyl)-4-bromo-3-(carboxymethyloxy)thiophene-2-carboxylic acid CAS Name: 5-(3-benzamidophenyl)-4-bromo-3-(carboxymethyloxy)-2-thiophenecarboxylic acid IUPAC Name: 5-(3-benzamidophenyl)-4-bromo-3-(carboxymethyloxy)thiophene-2-carboxylic acid Traditional Name: 5-(3-benzamidophenyl)-4-bromo-3-(carboxymethyloxy)-2-thenoic acid Formula: C20H14BrNO6S MolecularWeight: 476.29726

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=C(C(=C(S3)C(=O)O)OCC(=O)O)Br

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=C(C(=C(S3)C(=O)O)OCC(=O)O)Br

InChI

InChI=1S/C20H14BrNO6S/c21-15-16(28-10-14(23)24)18(20(26)27)29-17(15)12-7-4-8-13(9-12)22-19(25)11-5-2-1-3-6-11/h1-9H,10H2,(H,22,25)(H,23,24)(H,26,27)