[(1R,5S)-2-methyl-8-pyridin-3-yl-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl ethanoate

Systemtic Name: [(1R,5S)-2-methyl-8-pyridin-3-yl-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl ethanoate Openeye Name: [(1R,5S)-2-methyl-8-(3-pyridyl)-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl acetate CAS Name: acetic acid [(1R,5S)-2-methyl-8-(3-pyridinyl)-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl ester IUPAC Name: [(1R,5S)-2-methyl-8-pyridin-3-yl-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl acetate Traditional Name: acetic acid [(1R,5S)-2-methyl-8-(3-pyridyl)-7-oxabicyclo[3.3.1]non-2-en-5-yl]methyl ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC2(CC1C(OC2)C3=CN=CC=C3)COC(=O)C

Isomeric SMILES

CC1=CC[C@@]2(C[C@H]1C(OC2)C3=CN=CC=C3)COC(=O)C

InChI

InChI=1S/C17H21NO3/c1-12-5-6-17(10-20-13(2)19)8-15(12)16(21-11-17)14-4-3-7-18-9-14/h3-5,7,9,15-16H,6,8,10-11H2,1-2H3/t15-,16?,17-/m1/s1