1,3-benzodioxol-5-ylmethyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Openeye Name: 1,3-benzodioxol-5-ylmethyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate CAS Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl 4-[(4-chlorophenyl)sulfanylmethyl]benzoate Traditional Name: 4-[[(4-chlorophenyl)thio]methyl]benzoic acid piperonyl ester Formula: C22H17ClO4S MolecularWeight: 412.88598

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)COC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)COC(=O)C3=CC=C(C=C3)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H17ClO4S/c23-18-6-8-19(9-7-18)28-13-15-1-4-17(5-2-15)22(24)25-12-16-3-10-20-21(11-16)27-14-26-20/h1-11H,12-14H2