heptan-3-yl 3-(oxan-2-yloxymethyl)benzoate

Systemtic Name: heptan-3-yl 3-(oxan-2-yloxymethyl)benzoate Openeye Name: 1-ethylpentyl 3-(tetrahydropyran-2-yloxymethyl)benzoate CAS Name: 3-(2-oxanyloxymethyl)benzoic acid heptan-3-yl ester IUPAC Name: heptan-3-yl 3-(oxan-2-yloxymethyl)benzoate Traditional Name: 3-(tetrahydropyran-2-yloxymethyl)benzoic acid 1-ethylpentyl ester Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)OC(=O)C1=CC(=CC=C1)COC2CCCCO2

Isomeric SMILES

CCCCC(CC)OC(=O)C1=CC(=CC=C1)COC2CCCCO2

InChI

InChI=1S/C20H30O4/c1-3-5-11-18(4-2)24-20(21)17-10-8-9-16(14-17)15-23-19-12-6-7-13-22-19/h8-10,14,18-19H,3-7,11-13,15H2,1-2H3