(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-thiophen-3-ylprop-2-enoate

Systemtic Name: (6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-thiophen-3-ylprop-2-enoate Openeye Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-(3-thienyl)prop-2-enoate CAS Name: (E)-3-(3-thiophenyl)-2-propenoic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester IUPAC Name: (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl (E)-3-thiophen-3-ylprop-2-enoate Traditional Name: (E)-3-(3-thienyl)acrylic acid (6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)methyl ester Formula: C16H13BrO4S MolecularWeight: 381.24102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)C=CC3=CSC=C3

Isomeric SMILES

C1COC2=C(O1)C=C(C(=C2)Br)COC(=O)/C=C/C3=CSC=C3

InChI

InChI=1S/C16H13BrO4S/c17-13-8-15-14(19-4-5-20-15)7-12(13)9-21-16(18)2-1-11-3-6-22-10-11/h1-3,6-8,10H,4-5,9H2/b2-1+