1,3-benzodioxol-5-yl 2-(4-methylphenyl)sulfanylethanoate

Systemtic Name: 1,3-benzodioxol-5-yl 2-(4-methylphenyl)sulfanylethanoate Openeye Name: 1,3-benzodioxol-5-yl 2-(p-tolylsulfanyl)acetate CAS Name: 2-[(4-methylphenyl)thio]acetic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 2-(4-methylphenyl)sulfanylacetate Traditional Name: 2-(p-tolylthio)acetic acid 1,3-benzodioxol-5-yl ester Formula: C16H14O4S MolecularWeight: 302.34496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)OC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)OC2=CC3=C(C=C2)OCO3

InChI

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