(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-acetamidothiophene-2-carboxylate

Systemtic Name: (5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-acetamidothiophene-2-carboxylate Openeye Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-acetamidothiophene-2-carboxylate CAS Name: 5-acetamido-2-thiophenecarboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl 5-acetamidothiophene-2-carboxylate Traditional Name: 5-acetamidothiophene-2-carboxylic acid (5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C16H14ClNO5S MolecularWeight: 367.80406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(S1)C(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3

Isomeric SMILES

CC(=O)NC1=CC=C(S1)C(=O)OCC2=CC3=C(C(=C2)Cl)OCCO3

InChI

InChI=1S/C16H14ClNO5S/c1-9(19)18-14-3-2-13(24-14)16(20)23-8-10-6-11(17)15-12(7-10)21-4-5-22-15/h2-3,6-7H,4-5,8H2,1H3,(H,18,19)