(1S,6R)-4-methyl-6-(pyridin-3-ylcarbamoyl)cyclohex-3-ene-1-carboxylate

Systemtic Name: (1S,6R)-4-methyl-6-(pyridin-3-ylcarbamoyl)cyclohex-3-ene-1-carboxylate Openeye Name: (1S,6R)-4-methyl-6-(3-pyridylcarbamoyl)cyclohex-3-ene-1-carboxylate CAS Name: (1S,6R)-4-methyl-6-[oxo-(3-pyridinylamino)methyl]-1-cyclohex-3-enecarboxylate IUPAC Name: (1S,6R)-4-methyl-6-(pyridin-3-ylcarbamoyl)cyclohex-3-ene-1-carboxylate Traditional Name: (1S,6R)-4-methyl-6-(3-pyridylcarbamoyl)cyclohex-3-ene-1-carboxylate Formula: C14H15N2O3- MolecularWeight: 259.2805

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1)C(=O)NC2=CN=CC=C2)C(=O)[O-]

Isomeric SMILES

CC1=CC[C@@H]([C@@H](C1)C(=O)NC2=CN=CC=C2)C(=O)[O-]

InChI

InChI=1S/C14H16N2O3/c1-9-4-5-11(14(18)19)12(7-9)13(17)16-10-3-2-6-15-8-10/h2-4,6,8,11-12H,5,7H2,1H3,(H,16,17)(H,18,19)/p-1/t11-,12+/m0/s1