ethyl (E)-5-(1,3-dithian-2-yl)-5-phenylmethoxy-hex-2-enoate

Systemtic Name: ethyl (E)-5-(1,3-dithian-2-yl)-5-phenylmethoxy-hex-2-enoate Openeye Name: ethyl (E)-5-benzyloxy-5-(1,3-dithian-2-yl)hex-2-enoate CAS Name: (E)-5-(1,3-dithian-2-yl)-5-phenylmethoxy-2-hexenoic acid ethyl ester IUPAC Name: ethyl (E)-5-(1,3-dithian-2-yl)-5-phenylmethoxyhex-2-enoate Traditional Name: (E)-5-benzoxy-5-(1,3-dithian-2-yl)hex-2-enoic acid ethyl ester Formula: C19H26O3S2 MolecularWeight: 366.53794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCC(C)(C1SCCCS1)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)/C=C/CC(C)(C1SCCCS1)OCC2=CC=CC=C2

InChI

InChI=1S/C19H26O3S2/c1-3-21-17(20)11-7-12-19(2,18-23-13-8-14-24-18)22-15-16-9-5-4-6-10-16/h4-7,9-11,18H,3,8,12-15H2,1-2H3/b11-7+