2-thiocyanato-2-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)ethanoic acid

Systemtic Name: 2-thiocyanato-2-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)ethanoic acid Openeye Name: 2-thiocyanato-2-(1,7,7-trimethylnorbornan-2-yl)acetic acid CAS Name: 2-thiocyanato-2-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)acetic acid IUPAC Name: 2-thiocyanato-2-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)acetic acid Traditional Name: 2-(2-bornyl)-2-thiocyanato-acetic acid Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(C2)C(C(=O)O)SC#N)C)C

Isomeric SMILES

CC1(C2CCC1(C(C2)C(C(=O)O)SC#N)C)C

InChI

InChI=1S/C13H19NO2S/c1-12(2)8-4-5-13(12,3)9(6-8)10(11(15)16)17-7-14/h8-10H,4-6H2,1-3H3,(H,15,16)