(2-cyanophenyl)methyl 2-[4-(1,3-dithian-2-yl)phenoxy]ethanoate

Systemtic Name: (2-cyanophenyl)methyl 2-[4-(1,3-dithian-2-yl)phenoxy]ethanoate Openeye Name: (2-cyanophenyl)methyl 2-[4-(1,3-dithian-2-yl)phenoxy]acetate CAS Name: 2-[4-(1,3-dithian-2-yl)phenoxy]acetic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 2-[4-(1,3-dithian-2-yl)phenoxy]acetate Traditional Name: 2-[4-(1,3-dithian-2-yl)phenoxy]acetic acid (2-cyanobenzyl) ester Formula: C20H19NO3S2 MolecularWeight: 385.49976

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC(SC1)C2=CC=C(C=C2)OCC(=O)OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CSC(SC1)C2=CC=C(C=C2)OCC(=O)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H19NO3S2/c21-12-16-4-1-2-5-17(16)13-24-19(22)14-23-18-8-6-15(7-9-18)20-25-10-3-11-26-20/h1-2,4-9,20H,3,10-11,13-14H2