(3-ethylphenyl) 3-(hydroxymethyl)-5-methyl-hexanoate

Systemtic Name: (3-ethylphenyl) 3-(hydroxymethyl)-5-methyl-hexanoate Openeye Name: (3-ethylphenyl) 3-(hydroxymethyl)-5-methyl-hexanoate CAS Name: 3-(hydroxymethyl)-5-methylhexanoic acid (3-ethylphenyl) ester IUPAC Name: (3-ethylphenyl) 3-(hydroxymethyl)-5-methylhexanoate Traditional Name: 5-methyl-3-methylol-hexanoic acid (3-ethylphenyl) ester Formula: C16H24O3 MolecularWeight: 264.35996

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)OC(=O)CC(CC(C)C)CO

Isomeric SMILES

CCC1=CC(=CC=C1)OC(=O)CC(CC(C)C)CO

InChI

InChI=1S/C16H24O3/c1-4-13-6-5-7-15(9-13)19-16(18)10-14(11-17)8-12(2)3/h5-7,9,12,14,17H,4,8,10-11H2,1-3H3