[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate

Systemtic Name: [2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate Openeye Name: [2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl] 2-[(5-chloro-2-thienyl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]acetic acid [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] ester IUPAC Name: [2-(1,3-benzodioxol-5-yl)-2-oxoethyl] 2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]acetic acid [2-(1,3-benzodioxol-5-yl)-2-keto-ethyl] ester Formula: C16H13ClO5S2 MolecularWeight: 384.85442

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)COC(=O)CSCC3=CC=C(S3)Cl

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)COC(=O)CSCC3=CC=C(S3)Cl

InChI

InChI=1S/C16H13ClO5S2/c17-15-4-2-11(24-15)7-23-8-16(19)20-6-12(18)10-1-3-13-14(5-10)22-9-21-13/h1-5H,6-9H2