[(1S,6R)-6-(cyanomethyl)cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1S,6R)-6-(cyanomethyl)cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1S,6R)-6-(cyanomethyl)cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1S,6R)-6-(cyanomethyl)-1-cyclohex-3-enyl] ester IUPAC Name: [(1S,6R)-6-(cyanomethyl)cyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1S,6R)-6-(cyanomethyl)cyclohex-3-en-1-yl] ester Formula: C10H13NO2 MolecularWeight: 179.21572

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC=CCC1CC#N

Isomeric SMILES

CC(=O)O[C@H]1CC=CC[C@@H]1CC#N

InChI

InChI=1S/C10H13NO2/c1-8(12)13-10-5-3-2-4-9(10)6-7-11/h2-3,9-10H,4-6H2,1H3/t9-,10+/m1/s1