7-(2-phenyl-1,3-dithian-2-yl)heptyl ethanoate

Systemtic Name: 7-(2-phenyl-1,3-dithian-2-yl)heptyl ethanoate Openeye Name: 7-(2-phenyl-1,3-dithian-2-yl)heptyl acetate CAS Name: acetic acid 7-(2-phenyl-1,3-dithian-2-yl)heptyl ester IUPAC Name: 7-(2-phenyl-1,3-dithian-2-yl)heptyl acetate Traditional Name: acetic acid 7-(2-phenyl-1,3-dithian-2-yl)heptyl ester Formula: C19H28O2S2 MolecularWeight: 352.55442

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCCCC1(SCCCS1)C2=CC=CC=C2

Isomeric SMILES

CC(=O)OCCCCCCCC1(SCCCS1)C2=CC=CC=C2

InChI

InChI=1S/C19H28O2S2/c1-17(20)21-14-9-4-2-3-8-13-19(22-15-10-16-23-19)18-11-6-5-7-12-18/h5-7,11-12H,2-4,8-10,13-16H2,1H3