(2S,4S)-4-methyl-2-[(1E)-3-methylbuta-1,3-dienyl]oxepane

Systemtic Name: (2S,4S)-4-methyl-2-[(1E)-3-methylbuta-1,3-dienyl]oxepane Openeye Name: (2S,4S)-4-methyl-2-[(1E)-3-methylbuta-1,3-dienyl]oxepane CAS Name: (2S,4S)-4-methyl-2-[(1E)-3-methylbuta-1,3-dienyl]oxepane IUPAC Name: (2S,4S)-4-methyl-2-[(1E)-3-methylbuta-1,3-dienyl]oxepane Traditional Name: (2S,4S)-4-methyl-2-[(1E)-3-methylbuta-1,3-dienyl]oxepane Formula: C12H20O MolecularWeight: 180.2866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCOC(C1)C=CC(=C)C

Isomeric SMILES

C[C@H]1CCCO[C@@H](C1)/C=C/C(=C)C

InChI

InChI=1S/C12H20O/c1-10(2)6-7-12-9-11(3)5-4-8-13-12/h6-7,11-12H,1,4-5,8-9H2,2-3H3/b7-6+/t11-,12+/m0/s1