(4-acetamidophenyl) 5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxylate

Systemtic Name: (4-acetamidophenyl) 5-chloranyl-2,3-dihydro-1,4-benzodioxine-7-carboxylate Openeye Name: (4-acetamidophenyl) 5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxylate CAS Name: 5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (4-acetamidophenyl) ester IUPAC Name: (4-acetamidophenyl) 5-chloro-2,3-dihydro-1,4-benzodioxine-7-carboxylate Traditional Name: 5-chloro-2,3-dihydro-1,4-benzodioxin-7-carboxylic acid (4-acetamidophenyl) ester Formula: C17H14ClNO5 MolecularWeight: 347.74976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)OC(=O)C2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C17H14ClNO5/c1-10(20)19-12-2-4-13(5-3-12)24-17(21)11-8-14(18)16-15(9-11)22-6-7-23-16/h2-5,8-9H,6-7H2,1H3,(H,19,20)