2-(4-thiocyanatonaphthalen-1-yl)oxyethanoic acid

Systemtic Name: 2-(4-thiocyanatonaphthalen-1-yl)oxyethanoic acid Openeye Name: 2-[(4-thiocyanato-1-naphthyl)oxy]acetic acid CAS Name: 2-[(4-thiocyanato-1-naphthalenyl)oxy]acetic acid IUPAC Name: 2-(4-thiocyanatonaphthalen-1-yl)oxyacetic acid Traditional Name: 2-(4-thiocyanato-1-naphthoxy)acetic acid Formula: C13H9NO3S MolecularWeight: 259.28046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=C2SC#N)OCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=C2SC#N)OCC(=O)O

InChI

InChI=1S/C13H9NO3S/c14-8-18-12-6-5-11(17-7-13(15)16)9-3-1-2-4-10(9)12/h1-6H,7H2,(H,15,16)