2-chloranylprop-2-enyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate

Systemtic Name: 2-chloranylprop-2-enyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]sulfanylbenzoate Openeye Name: 2-chloroallyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]thio]benzoic acid 2-chloroprop-2-enyl ester IUPAC Name: 2-chloroprop-2-enyl 2-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]sulfanylbenzoate Traditional Name: 2-[[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]thio]benzoic acid 2-chloroallyl ester Formula: C19H16ClNO5S MolecularWeight: 405.85204

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Descriptors Computed from Structure

Canonical SMILES:

C=C(COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)Cl

Isomeric SMILES

C=C(COC(=O)C1=CC=CC=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)Cl

InChI

InChI=1S/C19H16ClNO5S/c1-12(20)9-24-19(23)14-4-2-3-5-17(14)27-10-18(22)21-13-6-7-15-16(8-13)26-11-25-15/h2-8H,1,9-11H2,(H,21,22)