5-oxidanylhexan-2-yl 2-oxidanylbenzoate

Systemtic Name: 5-oxidanylhexan-2-yl 2-oxidanylbenzoate Openeye Name: (4-hydroxy-1-methyl-pentyl) 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid 5-hydroxyhexan-2-yl ester IUPAC Name: 5-hydroxyhexan-2-yl 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid (4-hydroxy-1-methyl-pentyl) ester Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C)OC(=O)C1=CC=CC=C1O)O

Isomeric SMILES

CC(CCC(C)OC(=O)C1=CC=CC=C1O)O

InChI

InChI=1S/C13H18O4/c1-9(14)7-8-10(2)17-13(16)11-5-3-4-6-12(11)15/h3-6,9-10,14-15H,7-8H2,1-2H3