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O-[(2-cyanophenyl)methyl] methanethioate

O-[(2-cyanophenyl)methyl] methanethioate

Systemtic Name:O-[(2-cyanophenyl)methyl] methanethioate
Openeye Name:O-[(2-cyanophenyl)methyl] methanethioate
CAS Name:methanethioic acid O-[(2-cyanophenyl)methyl] ester
IUPAC Name:O-[(2-cyanophenyl)methyl] methanethioate
Traditional Name:methanethioic acid O-(2-cyanobenzyl) ester
Formula: C9H7NOS
MolecularWeight: 177.22298
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)COC=S)C#N


Isomeric SMILES

C1=CC=C(C(=C1)COC=S)C#N


InChI

InChI=1S/C9H7NOS/c10-5-8-3-1-2-4-9(8)6-11-7-12/h1-4,7H,6H2


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