methyl 2-(2-thiocyanatopyrrol-1-yl)benzoate

Systemtic Name: methyl 2-(2-thiocyanatopyrrol-1-yl)benzoate Openeye Name: methyl 2-(2-thiocyanatopyrrol-1-yl)benzoate CAS Name: 2-(2-thiocyanato-1-pyrrolyl)benzoic acid methyl ester IUPAC Name: methyl 2-(2-thiocyanatopyrrol-1-yl)benzoate Traditional Name: 2-(2-thiocyanatopyrrol-1-yl)benzoic acid methyl ester Formula: C13H10N2O2S MolecularWeight: 258.2957

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1N2C=CC=C2SC#N

Isomeric SMILES

COC(=O)C1=CC=CC=C1N2C=CC=C2SC#N

InChI

InChI=1S/C13H10N2O2S/c1-17-13(16)10-5-2-3-6-11(10)15-8-4-7-12(15)18-9-14/h2-8H,1H3