2-(3-methylphenyl)-3-[(1E,3E)-trideca-1,3-dienyl]oxirane

Systemtic Name: 2-(3-methylphenyl)-3-[(1E,3E)-trideca-1,3-dienyl]oxirane Openeye Name: 2-(m-tolyl)-3-[(1E,3E)-trideca-1,3-dienyl]oxirane CAS Name: 2-(3-methylphenyl)-3-[(1E,3E)-trideca-1,3-dienyl]oxirane IUPAC Name: 2-(3-methylphenyl)-3-[(1E,3E)-trideca-1,3-dienyl]oxirane Traditional Name: 2-(m-tolyl)-3-[(1E,3E)-trideca-1,3-dienyl]oxirane Formula: C22H32O MolecularWeight: 312.48888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC=CC=CC1C(O1)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCCCCCC/C=C/C=C/C1C(O1)C2=CC(=CC=C2)C

InChI

InChI=1S/C22H32O/c1-3-4-5-6-7-8-9-10-11-12-13-17-21-22(23-21)20-16-14-15-19(2)18-20/h11-18,21-22H,3-10H2,1-2H3/b12-11+,17-13+