1,3-benzodioxol-5-yl 4-(methylsulfanylmethyl)benzoate

Systemtic Name: 1,3-benzodioxol-5-yl 4-(methylsulfanylmethyl)benzoate Openeye Name: 1,3-benzodioxol-5-yl 4-(methylsulfanylmethyl)benzoate CAS Name: 4-[(methylthio)methyl]benzoic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 4-(methylsulfanylmethyl)benzoate Traditional Name: 4-[(methylthio)methyl]benzoic acid 1,3-benzodioxol-5-yl ester Formula: C16H14O4S MolecularWeight: 302.34496

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CSCC1=CC=C(C=C1)C(=O)OC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H14O4S/c1-21-9-11-2-4-12(5-3-11)16(17)20-13-6-7-14-15(8-13)19-10-18-14/h2-8H,9-10H2,1H3