(1S,2R)-2-(furan-2-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid

Systemtic Name: (1S,2R)-2-(furan-2-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid Openeye Name: (1S,2R)-2-(2-furylmethylcarbamoyl)cyclohexanecarboxylic acid CAS Name: (1S,2R)-2-[(2-furanylmethylamino)-oxomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: (1S,2R)-2-(furan-2-ylmethylcarbamoyl)cyclohexane-1-carboxylic acid Traditional Name: (1S,2R)-2-(2-furfurylcarbamoyl)cyclohexanecarboxylic acid Formula: C13H17NO4 MolecularWeight: 251.27838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCC2=CC=CO2)C(=O)O

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)C(=O)NCC2=CC=CO2)C(=O)O

InChI

InChI=1S/C13H17NO4/c15-12(14-8-9-4-3-7-18-9)10-5-1-2-6-11(10)13(16)17/h3-4,7,10-11H,1-2,5-6,8H2,(H,14,15)(H,16,17)/t10-,11+/m1/s1