4,6-bis[(2,6-dimethylphenoxy)methyl]nonan-5-one

Systemtic Name: 4,6-bis[(2,6-dimethylphenoxy)methyl]nonan-5-one Openeye Name: 4,6-bis[(2,6-dimethylphenoxy)methyl]nonan-5-one CAS Name: 4,6-bis[(2,6-dimethylphenoxy)methyl]-5-nonanone IUPAC Name: 4,6-bis[(2,6-dimethylphenoxy)methyl]nonan-5-one Traditional Name: 4,6-bis[(2,6-dimethylphenoxy)methyl]nonan-5-one Formula: C27H38O3 MolecularWeight: 410.58882

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(COC1=C(C=CC=C1C)C)C(=O)C(CCC)COC2=C(C=CC=C2C)C

Isomeric SMILES

CCCC(COC1=C(C=CC=C1C)C)C(=O)C(CCC)COC2=C(C=CC=C2C)C

InChI

InChI=1S/C27H38O3/c1-7-11-23(17-29-26-19(3)13-9-14-20(26)4)25(28)24(12-8-2)18-30-27-21(5)15-10-16-22(27)6/h9-10,13-16,23-24H,7-8,11-12,17-18H2,1-6H3