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heptan-3-yl 3-(hydroxymethyl)benzoate

heptan-3-yl 3-(hydroxymethyl)benzoate

Systemtic Name:heptan-3-yl 3-(hydroxymethyl)benzoate
Openeye Name:1-ethylpentyl 3-(hydroxymethyl)benzoate
CAS Name:3-(hydroxymethyl)benzoic acid heptan-3-yl ester
IUPAC Name:heptan-3-yl 3-(hydroxymethyl)benzoate
Traditional Name:3-methylolbenzoic acid 1-ethylpentyl ester
Formula: C15H22O3
MolecularWeight: 250.33338
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H22O3/c1-3-5-9-14(4-2)18-15(17)13-8-6-7-12(10-13)11-16/h6-8,10,14,16H,3-5,9,11H2,1-2H3


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