(4-cyanophenyl) 4-(4-butylphenyl)carbonyloxy-2-chloranyl-benzoate

Systemtic Name: (4-cyanophenyl) 4-(4-butylphenyl)carbonyloxy-2-chloranyl-benzoate Openeye Name: (4-cyanophenyl) 4-(4-butylbenzoyl)oxy-2-chloro-benzoate CAS Name: 4-[(4-butylphenyl)-oxomethoxy]-2-chlorobenzoic acid (4-cyanophenyl) ester IUPAC Name: (4-cyanophenyl) 4-(4-butylbenzoyl)oxy-2-chlorobenzoate Traditional Name: 4-(4-butylbenzoyl)oxy-2-chloro-benzoic acid (4-cyanophenyl) ester Formula: C25H20ClNO4 MolecularWeight: 433.8836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OC2=CC(=C(C=C2)C(=O)OC3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C25H20ClNO4/c1-2-3-4-17-5-9-19(10-6-17)24(28)31-21-13-14-22(23(26)15-21)25(29)30-20-11-7-18(16-27)8-12-20/h5-15H,2-4H2,1H3