cyano 2-(3,4-dichlorophenyl)-3-ethyl-2-[1-(oxan-2-yloxy)ethyl]pentanoate

Systemtic Name: cyano 2-(3,4-dichlorophenyl)-3-ethyl-2-[1-(oxan-2-yloxy)ethyl]pentanoate Openeye Name: cyano 2-(3,4-dichlorophenyl)-3-ethyl-2-(1-tetrahydropyran-2-yloxyethyl)pentanoate CAS Name: 2-(3,4-dichlorophenyl)-3-ethyl-2-[1-(2-oxanyloxy)ethyl]pentanoic acid cyano ester IUPAC Name: cyano 2-(3,4-dichlorophenyl)-3-ethyl-2-[1-(oxan-2-yloxy)ethyl]pentanoate Traditional Name: 2-(3,4-dichlorophenyl)-3-ethyl-2-(1-tetrahydropyran-2-yloxyethyl)valeric acid cyano ester Formula: C21H27Cl2NO4 MolecularWeight: 428.34938

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(C1=CC(=C(C=C1)Cl)Cl)(C(C)OC2CCCCO2)C(=O)OC#N

Isomeric SMILES

CCC(CC)C(C1=CC(=C(C=C1)Cl)Cl)(C(C)OC2CCCCO2)C(=O)OC#N

InChI

InChI=1S/C21H27Cl2NO4/c1-4-15(5-2)21(20(25)27-13-24,16-9-10-17(22)18(23)12-16)14(3)28-19-8-6-7-11-26-19/h9-10,12,14-15,19H,4-8,11H2,1-3H3