(2-chloranyl-4-cyano-phenyl) 3-(2,4-dimethylphenyl)propanoate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 3-(2,4-dimethylphenyl)propanoate Openeye Name: (2-chloro-4-cyano-phenyl) 3-(2,4-dimethylphenyl)propanoate CAS Name: 3-(2,4-dimethylphenyl)propanoic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 3-(2,4-dimethylphenyl)propanoate Traditional Name: 3-(2,4-dimethylphenyl)propionic acid (2-chloro-4-cyano-phenyl) ester Formula: C18H16ClNO2 MolecularWeight: 313.77814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)C#N)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCC(=O)OC2=C(C=C(C=C2)C#N)Cl)C

InChI

InChI=1S/C18H16ClNO2/c1-12-3-5-15(13(2)9-12)6-8-18(21)22-17-7-4-14(11-20)10-16(17)19/h3-5,7,9-10H,6,8H2,1-2H3