propan-2-yl 3-oxidanyl-3-phenethyl-hexanoate

Systemtic Name: propan-2-yl 3-oxidanyl-3-phenethyl-hexanoate Openeye Name: isopropyl 3-hydroxy-3-phenethyl-hexanoate CAS Name: 3-hydroxy-3-phenethylhexanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-hydroxy-3-phenethylhexanoate Traditional Name: 3-hydroxy-3-phenethyl-hexanoic acid isopropyl ester Formula: C17H26O3 MolecularWeight: 278.38654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26O3/c1-4-11-17(19,13-16(18)20-14(2)3)12-10-15-8-6-5-7-9-15/h5-9,14,19H,4,10-13H2,1-3H3