methyl 3-phenyl-2-thiocyanato-propanoate

Systemtic Name: methyl 3-phenyl-2-thiocyanato-propanoate Openeye Name: methyl 3-phenyl-2-thiocyanato-propanoate CAS Name: 3-phenyl-2-thiocyanatopropanoic acid methyl ester IUPAC Name: methyl 3-phenyl-2-thiocyanatopropanoate Traditional Name: 3-phenyl-2-thiocyanato-propionic acid methyl ester Formula: C11H11NO2S MolecularWeight: 221.27554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)SC#N

Isomeric SMILES

COC(=O)C(CC1=CC=CC=C1)SC#N

InChI

InChI=1S/C11H11NO2S/c1-14-11(13)10(15-8-12)7-9-5-3-2-4-6-9/h2-6,10H,7H2,1H3