methyl (1R,6S)-6-(6-chloranylpyridin-3-yl)cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl (1R,6S)-6-(6-chloranylpyridin-3-yl)cyclohex-3-ene-1-carboxylate Openeye Name: methyl (1R,6S)-6-(6-chloro-3-pyridyl)cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-(6-chloro-3-pyridinyl)-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,6S)-6-(6-chloropyridin-3-yl)cyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-(6-chloro-3-pyridyl)cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C13H14ClNO2 MolecularWeight: 251.70876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC=CCC1C2=CN=C(C=C2)Cl

Isomeric SMILES

COC(=O)[C@@H]1CC=CC[C@@H]1C2=CN=C(C=C2)Cl

InChI

InChI=1S/C13H14ClNO2/c1-17-13(16)11-5-3-2-4-10(11)9-6-7-12(14)15-8-9/h2-3,6-8,10-11H,4-5H2,1H3/t10-,11-/m1/s1