2-(4-thiocyanatophenyl)ethanoic acid

Systemtic Name: 2-(4-thiocyanatophenyl)ethanoic acid Openeye Name: 2-(4-thiocyanatophenyl)acetic acid CAS Name: 2-(4-thiocyanatophenyl)acetic acid IUPAC Name: 2-(4-thiocyanatophenyl)acetic acid Traditional Name: 2-(4-thiocyanatophenyl)acetic acid Formula: C9H7NO2S MolecularWeight: 193.22238

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(=O)O)SC#N

Isomeric SMILES

C1=CC(=CC=C1CC(=O)O)SC#N

InChI

InChI=1S/C9H7NO2S/c10-6-13-8-3-1-7(2-4-8)5-9(11)12/h1-4H,5H2,(H,11,12)