ethyl 4-cyano-2-[(3,4-dichlorophenyl)methyl]-6-(oxan-2-yloxy)hexanoate

Systemtic Name: ethyl 4-cyano-2-[(3,4-dichlorophenyl)methyl]-6-(oxan-2-yloxy)hexanoate Openeye Name: ethyl 4-cyano-2-[(3,4-dichlorophenyl)methyl]-6-tetrahydropyran-2-yloxy-hexanoate CAS Name: 4-cyano-2-[(3,4-dichlorophenyl)methyl]-6-(2-oxanyloxy)hexanoic acid ethyl ester IUPAC Name: ethyl 4-cyano-2-[(3,4-dichlorophenyl)methyl]-6-(oxan-2-yloxy)hexanoate Traditional Name: 4-cyano-2-(3,4-dichlorobenzyl)-6-tetrahydropyran-2-yloxy-hexanoic acid ethyl ester Formula: C21H27Cl2NO4 MolecularWeight: 428.34938

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC(=C(C=C1)Cl)Cl)CC(CCOC2CCCCO2)C#N

Isomeric SMILES

CCOC(=O)C(CC1=CC(=C(C=C1)Cl)Cl)CC(CCOC2CCCCO2)C#N

InChI

InChI=1S/C21H27Cl2NO4/c1-2-26-21(25)17(11-15-6-7-18(22)19(23)13-15)12-16(14-24)8-10-28-20-5-3-4-9-27-20/h6-7,13,16-17,20H,2-5,8-12H2,1H3