(3S)-4,4-dimethyl-3-(oxan-2-yloxy)-5-oxidanylidene-heptanal

Systemtic Name: (3S)-4,4-dimethyl-3-(oxan-2-yloxy)-5-oxidanylidene-heptanal Openeye Name: (3S)-4,4-dimethyl-5-oxo-3-tetrahydropyran-2-yloxy-heptanal CAS Name: (3S)-4,4-dimethyl-3-(2-oxanyloxy)-5-oxoheptanal IUPAC Name: (3S)-4,4-dimethyl-3-(oxan-2-yloxy)-5-oxoheptanal Traditional Name: (3S)-5-keto-4,4-dimethyl-3-tetrahydropyran-2-yloxy-enanthaldehyde Formula: C14H24O4 MolecularWeight: 256.33796

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(C)(C)C(CC=O)OC1CCCCO1

Isomeric SMILES

CCC(=O)C(C)(C)[C@H](CC=O)OC1CCCCO1

InChI

InChI=1S/C14H24O4/c1-4-11(16)14(2,3)12(8-9-15)18-13-7-5-6-10-17-13/h9,12-13H,4-8,10H2,1-3H3/t12-,13?/m0/s1