[(2-cyanophenoxy)-phenyl-methyl] 2-[chloranyl(phenyl)methyl]-2-ethyl-hexanoate

Systemtic Name: [(2-cyanophenoxy)-phenyl-methyl] 2-[chloranyl(phenyl)methyl]-2-ethyl-hexanoate Openeye Name: [(2-cyanophenoxy)-phenyl-methyl] 2-[chloro(phenyl)methyl]-2-ethyl-hexanoate CAS Name: 2-[chloro(phenyl)methyl]-2-ethylhexanoic acid [(2-cyanophenoxy)-phenylmethyl] ester IUPAC Name: [(2-cyanophenoxy)-phenylmethyl] 2-[chloro(phenyl)methyl]-2-ethylhexanoate Traditional Name: 2-[chloro(phenyl)methyl]-2-ethyl-hexanoic acid [(2-cyanophenoxy)-phenyl-methyl] ester Formula: C29H30ClNO3 MolecularWeight: 476.0064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)(C(C1=CC=CC=C1)Cl)C(=O)OC(C2=CC=CC=C2)OC3=CC=CC=C3C#N

Isomeric SMILES

CCCCC(CC)(C(C1=CC=CC=C1)Cl)C(=O)OC(C2=CC=CC=C2)OC3=CC=CC=C3C#N

InChI

InChI=1S/C29H30ClNO3/c1-3-5-20-29(4-2,26(30)22-14-8-6-9-15-22)28(32)34-27(23-16-10-7-11-17-23)33-25-19-13-12-18-24(25)21-31/h6-19,26-27H,3-5,20H2,1-2H3