3-[4-chloranyl-2-(cyanomethyl)phenyl]propyl ethanoate

Systemtic Name: 3-[4-chloranyl-2-(cyanomethyl)phenyl]propyl ethanoate Openeye Name: 3-[4-chloro-2-(cyanomethyl)phenyl]propyl acetate CAS Name: acetic acid 3-[4-chloro-2-(cyanomethyl)phenyl]propyl ester IUPAC Name: 3-[4-chloro-2-(cyanomethyl)phenyl]propyl acetate Traditional Name: acetic acid 3-[4-chloro-2-(cyanomethyl)phenyl]propyl ester Formula: C13H14ClNO2 MolecularWeight: 251.70876

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCC1=C(C=C(C=C1)Cl)CC#N

Isomeric SMILES

CC(=O)OCCCC1=C(C=C(C=C1)Cl)CC#N

InChI

InChI=1S/C13H14ClNO2/c1-10(16)17-8-2-3-11-4-5-13(14)9-12(11)6-7-15/h4-5,9H,2-3,6,8H2,1H3