[2-(bromomethyl)-4,4-dimethyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-yl] methanoate

Systemtic Name: [2-(bromomethyl)-4,4-dimethyl-3-[(E)-3-oxidanylidenebut-1-enyl]cyclohex-2-en-1-yl] methanoate Openeye Name: [2-(bromomethyl)-4,4-dimethyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-yl] formate CAS Name: formic acid [2-(bromomethyl)-4,4-dimethyl-3-[(E)-3-oxobut-1-enyl]-1-cyclohex-2-enyl] ester IUPAC Name: [2-(bromomethyl)-4,4-dimethyl-3-[(E)-3-oxobut-1-enyl]cyclohex-2-en-1-yl] formate Traditional Name: formic acid [2-(bromomethyl)-3-[(E)-3-ketobut-1-enyl]-4,4-dimethyl-cyclohex-2-en-1-yl] ester Formula: C14H19BrO3 MolecularWeight: 315.20286

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C=CC1=C(C(CCC1(C)C)OC=O)CBr

Isomeric SMILES

CC(=O)/C=C/C1=C(C(CCC1(C)C)OC=O)CBr

InChI

InChI=1S/C14H19BrO3/c1-10(17)4-5-12-11(8-15)13(18-9-16)6-7-14(12,2)3/h4-5,9,13H,6-8H2,1-3H3/b5-4+