[4-(4-cyanophenyl)phenyl] 2-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)ethanoate

Systemtic Name: [4-(4-cyanophenyl)phenyl] 2-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)ethanoate Openeye Name: [4-(4-cyanophenyl)phenyl] 2-(4-chloro-2-isopropyl-5-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetic acid [4-(4-cyanophenyl)phenyl] ester IUPAC Name: [4-(4-cyanophenyl)phenyl] 2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)acetate Traditional Name: 2-(4-chloro-2-isopropyl-5-methyl-phenoxy)acetic acid [4-(4-cyanophenyl)phenyl] ester Formula: C25H22ClNO3 MolecularWeight: 419.90008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)C(C)C)OCC(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1Cl)C(C)C)OCC(=O)OC2=CC=C(C=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C25H22ClNO3/c1-16(2)22-13-23(26)17(3)12-24(22)29-15-25(28)30-21-10-8-20(9-11-21)19-6-4-18(14-27)5-7-19/h4-13,16H,15H2,1-3H3