(2-ethoxy-4-methanoyl-phenyl) 4-(3-methylbutoxy)benzoate

Systemtic Name: (2-ethoxy-4-methanoyl-phenyl) 4-(3-methylbutoxy)benzoate Openeye Name: (2-ethoxy-4-formyl-phenyl) 4-isopentyloxybenzoate CAS Name: 4-(3-methylbutoxy)benzoic acid (2-ethoxy-4-formylphenyl) ester IUPAC Name: (2-ethoxy-4-formylphenyl) 4-(3-methylbutoxy)benzoate Traditional Name: 4-isoamoxybenzoic acid (2-ethoxy-4-formyl-phenyl) ester Formula: C21H24O5 MolecularWeight: 356.41226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=O)OC(=O)C2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=O)OC(=O)C2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C21H24O5/c1-4-24-20-13-16(14-22)5-10-19(20)26-21(23)17-6-8-18(9-7-17)25-12-11-15(2)3/h5-10,13-15H,4,11-12H2,1-3H3