(3-cyanophenyl)methyl 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate

Systemtic Name: (3-cyanophenyl)methyl 2-(8-chloranylnaphthalen-1-yl)sulfanylethanoate Openeye Name: (3-cyanophenyl)methyl 2-[(8-chloro-1-naphthyl)sulfanyl]acetate CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]acetic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-(8-chloronaphthalen-1-yl)sulfanylacetate Traditional Name: 2-[(8-chloro-1-naphthyl)thio]acetic acid (3-cyanobenzyl) ester Formula: C20H14ClNO2S MolecularWeight: 367.84866

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SCC(=O)OCC3=CC=CC(=C3)C#N)C(=CC=C2)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)SCC(=O)OCC3=CC=CC(=C3)C#N)C(=CC=C2)Cl

InChI

InChI=1S/C20H14ClNO2S/c21-17-8-2-6-16-7-3-9-18(20(16)17)25-13-19(23)24-12-15-5-1-4-14(10-15)11-22/h1-10H,12-13H2