4-[[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]carbamoyl]-2,5-dihydrothiophene-3-carboxylic acid

Systemtic Name: 4-[[3,5-bis(bromanyl)-4-phenylmethoxy-phenyl]carbamoyl]-2,5-dihydrothiophene-3-carboxylic acid Openeye Name: 4-[(4-benzyloxy-3,5-dibromo-phenyl)carbamoyl]-2,5-dihydrothiophene-3-carboxylic acid CAS Name: 4-[(3,5-dibromo-4-phenylmethoxyanilino)-oxomethyl]-2,5-dihydrothiophene-3-carboxylic acid IUPAC Name: 4-[(3,5-dibromo-4-phenylmethoxyphenyl)carbamoyl]-2,5-dihydrothiophene-3-carboxylic acid Traditional Name: 4-[(4-benzoxy-3,5-dibromo-phenyl)carbamoyl]-2,5-dihydrothiophene-3-carboxylic acid Formula: C19H15Br2NO4S MolecularWeight: 513.1997

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(CS1)C(=O)O)C(=O)NC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)Br

Isomeric SMILES

C1C(=C(CS1)C(=O)O)C(=O)NC2=CC(=C(C(=C2)Br)OCC3=CC=CC=C3)Br

InChI

InChI=1S/C19H15Br2NO4S/c20-15-6-12(22-18(23)13-9-27-10-14(13)19(24)25)7-16(21)17(15)26-8-11-4-2-1-3-5-11/h1-7H,8-10H2,(H,22,23)(H,24,25)