ethyl 2,4-diacetyloxy-6-[(E)-2-(5-bromanylthiophen-2-yl)ethenyl]benzoate

Systemtic Name: ethyl 2,4-diacetyloxy-6-[(E)-2-(5-bromanylthiophen-2-yl)ethenyl]benzoate Openeye Name: ethyl 2,4-diacetoxy-6-[(E)-2-(5-bromo-2-thienyl)vinyl]benzoate CAS Name: 2,4-diacetyloxy-6-[(E)-2-(5-bromo-2-thiophenyl)ethenyl]benzoic acid ethyl ester IUPAC Name: ethyl 2,4-diacetyloxy-6-[(E)-2-(5-bromothiophen-2-yl)ethenyl]benzoate Traditional Name: 2,4-diacetoxy-6-[(E)-2-(5-bromo-2-thienyl)vinyl]benzoic acid ethyl ester Formula: C19H17BrO6S MolecularWeight: 453.30368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(C=C1C=CC2=CC=C(S2)Br)OC(=O)C)OC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(C=C1/C=C/C2=CC=C(S2)Br)OC(=O)C)OC(=O)C

InChI

InChI=1S/C19H17BrO6S/c1-4-24-19(23)18-13(5-6-15-7-8-17(20)27-15)9-14(25-11(2)21)10-16(18)26-12(3)22/h5-10H,4H2,1-3H3/b6-5+