propyl 2-phenoxathiin-2-ylpropanoate

Systemtic Name: propyl 2-phenoxathiin-2-ylpropanoate Openeye Name: propyl 2-phenoxathiin-2-ylpropanoate CAS Name: 2-(2-phenoxathiinyl)propanoic acid propyl ester IUPAC Name: propyl 2-phenoxathiin-2-ylpropanoate Traditional Name: 2-phenoxathiin-2-ylpropionic acid propyl ester Formula: C18H18O3S MolecularWeight: 314.39872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C)C1=CC2=C(C=C1)OC3=CC=CC=C3S2

Isomeric SMILES

CCCOC(=O)C(C)C1=CC2=C(C=C1)OC3=CC=CC=C3S2

InChI

InChI=1S/C18H18O3S/c1-3-10-20-18(19)12(2)13-8-9-15-17(11-13)22-16-7-5-4-6-14(16)21-15/h4-9,11-12H,3,10H2,1-2H3