ethyl 5-[3,5-bis(chloranyl)phenyl]sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylate

Systemtic Name: ethyl 5-[3,5-bis(chloranyl)phenyl]sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylate Openeye Name: ethyl 5-(3,5-dichlorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylate CAS Name: 5-(3,5-dichlorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(3,5-dichlorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylate Traditional Name: 5-(3,5-dichlorophenyl)sulfonyl-6-methyl-1,3-benzodioxole-2-carboxylic acid ethyl ester Formula: C17H14Cl2O6S MolecularWeight: 417.26046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1OC2=C(O1)C=C(C(=C2)C)S(=O)(=O)C3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)C1OC2=C(O1)C=C(C(=C2)C)S(=O)(=O)C3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C17H14Cl2O6S/c1-3-23-16(20)17-24-13-4-9(2)15(8-14(13)25-17)26(21,22)12-6-10(18)5-11(19)7-12/h4-8,17H,3H2,1-2H3