methyl 5-isocyano-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 5-isocyano-1-benzothiophene-2-carboxylate Openeye Name: methyl 5-isocyanobenzothiophene-2-carboxylate CAS Name: 5-isocyano-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 5-isocyano-1-benzothiophene-2-carboxylate Traditional Name: 5-isocyanobenzothiophene-2-carboxylic acid methyl ester Formula: C11H7NO2S MolecularWeight: 217.24378

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(S1)C=CC(=C2)[N+]#[C-]

Isomeric SMILES

COC(=O)C1=CC2=C(S1)C=CC(=C2)[N+]#[C-]

InChI

InChI=1S/C11H7NO2S/c1-12-8-3-4-9-7(5-8)6-10(15-9)11(13)14-2/h3-6H,2H3