(1S,2R)-2-(1H-benzimidazol-2-yl)cyclohexane-1-carboxylate

Systemtic Name: (1S,2R)-2-(1H-benzimidazol-2-yl)cyclohexane-1-carboxylate Openeye Name: (1S,2R)-2-(1H-benzimidazol-2-yl)cyclohexanecarboxylate CAS Name: (1S,2R)-2-(1H-benzimidazol-2-yl)-1-cyclohexanecarboxylate IUPAC Name: (1S,2R)-2-(1H-benzimidazol-2-yl)cyclohexane-1-carboxylate Traditional Name: (1S,2R)-2-(1H-benzimidazol-2-yl)cyclohexanecarboxylate Formula: C14H15N2O2- MolecularWeight: 243.2811

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=NC3=CC=CC=C3N2)C(=O)[O-]

Isomeric SMILES

C1CC[C@@H]([C@@H](C1)C2=NC3=CC=CC=C3N2)C(=O)[O-]

InChI

InChI=1S/C14H16N2O2/c17-14(18)10-6-2-1-5-9(10)13-15-11-7-3-4-8-12(11)16-13/h3-4,7-10H,1-2,5-6H2,(H,15,16)(H,17,18)/p-1/t9-,10+/m1/s1