(4-cyanophenyl)methyl 2-(1-bromanylnaphthalen-2-yl)sulfanylethanoate

Systemtic Name: (4-cyanophenyl)methyl 2-(1-bromanylnaphthalen-2-yl)sulfanylethanoate Openeye Name: (4-cyanophenyl)methyl 2-[(1-bromo-2-naphthyl)sulfanyl]acetate CAS Name: 2-[(1-bromo-2-naphthalenyl)thio]acetic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 2-(1-bromonaphthalen-2-yl)sulfanylacetate Traditional Name: 2-[(1-bromo-2-naphthyl)thio]acetic acid (4-cyanobenzyl) ester Formula: C20H14BrNO2S MolecularWeight: 412.29966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2Br)SCC(=O)OCC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2Br)SCC(=O)OCC3=CC=C(C=C3)C#N

InChI

InChI=1S/C20H14BrNO2S/c21-20-17-4-2-1-3-16(17)9-10-18(20)25-13-19(23)24-12-15-7-5-14(11-22)6-8-15/h1-10H,12-13H2