6,7-bis(chloranyl)-5-(2-phenylethanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 6,7-bis(chloranyl)-5-(2-phenylethanoyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6,7-dichloro-5-(2-phenylacetyl)-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6,7-dichloro-5-(1-oxo-2-phenylethyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6,7-dichloro-5-(2-phenylacetyl)-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 6,7-dichloro-5-(2-phenylacetyl)coumaran-2-carboxylic acid Formula: C17H12Cl2O4 MolecularWeight: 351.18078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=C1C=C(C(=C2Cl)Cl)C(=O)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1C(OC2=C1C=C(C(=C2Cl)Cl)C(=O)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C17H12Cl2O4/c18-14-11(12(20)6-9-4-2-1-3-5-9)7-10-8-13(17(21)22)23-16(10)15(14)19/h1-5,7,13H,6,8H2,(H,21,22)