(1S,2R)-2-(butylcarbamoyl)cyclohexane-1-carboxylate

Systemtic Name: (1S,2R)-2-(butylcarbamoyl)cyclohexane-1-carboxylate Openeye Name: (1S,2R)-2-(butylcarbamoyl)cyclohexanecarboxylate CAS Name: (1S,2R)-2-[butylamino(oxo)methyl]-1-cyclohexanecarboxylate IUPAC Name: (1S,2R)-2-(butylcarbamoyl)cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-(butylcarbamoyl)cyclohexanecarboxylate Formula: C12H20NO3- MolecularWeight: 226.2921

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1CCCCC1C(=O)[O-]

Isomeric SMILES

CCCCNC(=O)[C@@H]1CCCC[C@@H]1C(=O)[O-]

InChI

InChI=1S/C12H21NO3/c1-2-3-8-13-11(14)9-6-4-5-7-10(9)12(15)16/h9-10H,2-8H2,1H3,(H,13,14)(H,15,16)/p-1/t9-,10+/m1/s1