phenyl 4-octoxy-2-propanoyloxy-benzoate

Systemtic Name: phenyl 4-octoxy-2-propanoyloxy-benzoate Openeye Name: phenyl 4-octoxy-2-propanoyloxy-benzoate CAS Name: 4-octoxy-2-(1-oxopropoxy)benzoic acid phenyl ester IUPAC Name: phenyl 4-octoxy-2-propanoyloxybenzoate Traditional Name: 4-octoxy-2-propionyloxy-benzoic acid phenyl ester Formula: C24H30O5 MolecularWeight: 398.492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)OC(=O)CC

Isomeric SMILES

CCCCCCCCOC1=CC(=C(C=C1)C(=O)OC2=CC=CC=C2)OC(=O)CC

InChI

InChI=1S/C24H30O5/c1-3-5-6-7-8-12-17-27-20-15-16-21(22(18-20)29-23(25)4-2)24(26)28-19-13-10-9-11-14-19/h9-11,13-16,18H,3-8,12,17H2,1-2H3