(1R,2R)-2-(2-pyridin-4-ylethylcarbamoyl)cyclohexane-1-carboxylate

Systemtic Name: (1R,2R)-2-(2-pyridin-4-ylethylcarbamoyl)cyclohexane-1-carboxylate Openeye Name: (1R,2R)-2-[2-(4-pyridyl)ethylcarbamoyl]cyclohexanecarboxylate CAS Name: (1R,2R)-2-[oxo-(2-pyridin-4-ylethylamino)methyl]-1-cyclohexanecarboxylate IUPAC Name: (1R,2R)-2-(2-pyridin-4-ylethylcarbamoyl)cyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-[2-(4-pyridyl)ethylcarbamoyl]cyclohexanecarboxylate Formula: C15H19N2O3- MolecularWeight: 275.32296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NCCC2=CC=NC=C2)C(=O)[O-]

Isomeric SMILES

C1CC[C@H]([C@@H](C1)C(=O)NCCC2=CC=NC=C2)C(=O)[O-]

InChI

InChI=1S/C15H20N2O3/c18-14(12-3-1-2-4-13(12)15(19)20)17-10-7-11-5-8-16-9-6-11/h5-6,8-9,12-13H,1-4,7,10H2,(H,17,18)(H,19,20)/p-1/t12-,13-/m1/s1