[(1R)-4-[(E)-2-iodanylethenyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] ethanoate

Systemtic Name: [(1R)-4-[(E)-2-iodanylethenyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] ethanoate Openeye Name: [(1R)-4-[(E)-2-iodovinyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] acetate CAS Name: acetic acid [(1R)-4-[(E)-2-iodoethenyl]-3,5,5-trimethyl-1-cyclohex-3-enyl] ester IUPAC Name: [(1R)-4-[(E)-2-iodoethenyl]-3,5,5-trimethylcyclohex-3-en-1-yl] acetate Traditional Name: acetic acid [(1R)-4-[(E)-2-iodovinyl]-3,5,5-trimethyl-cyclohex-3-en-1-yl] ester Formula: C13H19IO2 MolecularWeight: 334.19323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(C1)OC(=O)C)(C)C)C=CI

Isomeric SMILES

CC1=C(C(C[C@@H](C1)OC(=O)C)(C)C)/C=C/I

InChI

InChI=1S/C13H19IO2/c1-9-7-11(16-10(2)15)8-13(3,4)12(9)5-6-14/h5-6,11H,7-8H2,1-4H3/b6-5+/t11-/m1/s1