2-(2,4,4-trimethylpentyl)-1,3-dioxepane-5-carbaldehyde

Systemtic Name: 2-(2,4,4-trimethylpentyl)-1,3-dioxepane-5-carbaldehyde Openeye Name: 2-(2,4,4-trimethylpentyl)-1,3-dioxepane-5-carbaldehyde CAS Name: 2-(2,4,4-trimethylpentyl)-1,3-dioxepane-5-carboxaldehyde IUPAC Name: 2-(2,4,4-trimethylpentyl)-1,3-dioxepane-5-carbaldehyde Traditional Name: 2-(2,4,4-trimethylpentyl)-1,3-dioxepane-5-carbaldehyde Formula: C14H26O3 MolecularWeight: 242.35444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1OCCC(CO1)C=O)CC(C)(C)C

Isomeric SMILES

CC(CC1OCCC(CO1)C=O)CC(C)(C)C

InChI

InChI=1S/C14H26O3/c1-11(8-14(2,3)4)7-13-16-6-5-12(9-15)10-17-13/h9,11-13H,5-8,10H2,1-4H3