1,1-dimethoxyheptan-2-yl benzoate

Systemtic Name: 1,1-dimethoxyheptan-2-yl benzoate Openeye Name: 1-(dimethoxymethyl)hexyl benzoate CAS Name: benzoic acid 1,1-dimethoxyheptan-2-yl ester IUPAC Name: 1,1-dimethoxyheptan-2-yl benzoate Traditional Name: benzoic acid 1-(dimethoxymethyl)hexyl ester Formula: C16H24O4 MolecularWeight: 280.35936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(OC)OC)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCC(C(OC)OC)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C16H24O4/c1-4-5-7-12-14(16(18-2)19-3)20-15(17)13-10-8-6-9-11-13/h6,8-11,14,16H,4-5,7,12H2,1-3H3