(2E)-2-[2-(1,3-dioxan-2-yl)ethylidene]heptanal

Systemtic Name: (2E)-2-[2-(1,3-dioxan-2-yl)ethylidene]heptanal Openeye Name: (2E)-2-[2-(1,3-dioxan-2-yl)ethylidene]heptanal CAS Name: (2E)-2-[2-(1,3-dioxan-2-yl)ethylidene]heptanal IUPAC Name: (2E)-2-[2-(1,3-dioxan-2-yl)ethylidene]heptanal Traditional Name: (E)-2-amyl-4-(1,3-dioxan-2-yl)but-2-enal Formula: C13H22O3 MolecularWeight: 226.31198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=CCC1OCCCO1)C=O

Isomeric SMILES

CCCCC/C(=C\CC1OCCCO1)/C=O

InChI

InChI=1S/C13H22O3/c1-2-3-4-6-12(11-14)7-8-13-15-9-5-10-16-13/h7,11,13H,2-6,8-10H2,1H3/b12-7+