(3-cyanophenyl)methyl 2-(4-chloranyl-2,6-dimethyl-phenoxy)ethanoate

Systemtic Name: (3-cyanophenyl)methyl 2-(4-chloranyl-2,6-dimethyl-phenoxy)ethanoate Openeye Name: (3-cyanophenyl)methyl 2-(4-chloro-2,6-dimethyl-phenoxy)acetate CAS Name: 2-(4-chloro-2,6-dimethylphenoxy)acetic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 2-(4-chloro-2,6-dimethylphenoxy)acetate Traditional Name: 2-(4-chloro-2,6-dimethyl-phenoxy)acetic acid (3-cyanobenzyl) ester Formula: C18H16ClNO3 MolecularWeight: 329.77754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)OCC2=CC=CC(=C2)C#N)C)Cl

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)OCC2=CC=CC(=C2)C#N)C)Cl

InChI

InChI=1S/C18H16ClNO3/c1-12-6-16(19)7-13(2)18(12)23-11-17(21)22-10-15-5-3-4-14(8-15)9-20/h3-8H,10-11H2,1-2H3