[4-(4-heptoxyphenyl)phenyl] 3-chloranyl-4-(4-hexylphenyl)benzoate

Systemtic Name: [4-(4-heptoxyphenyl)phenyl] 3-chloranyl-4-(4-hexylphenyl)benzoate Openeye Name: [4-(4-heptoxyphenyl)phenyl] 3-chloro-4-(4-hexylphenyl)benzoate CAS Name: 3-chloro-4-(4-hexylphenyl)benzoic acid [4-(4-heptoxyphenyl)phenyl] ester IUPAC Name: [4-(4-heptoxyphenyl)phenyl] 3-chloro-4-(4-hexylphenyl)benzoate Traditional Name: 3-chloro-4-(4-hexylphenyl)benzoic acid [4-(4-heptoxyphenyl)phenyl] ester Formula: C38H43ClO3 MolecularWeight: 583.19922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4=CC=C(C=C4)CCCCCC)Cl

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4=CC=C(C=C4)CCCCCC)Cl

InChI

InChI=1S/C38H43ClO3/c1-3-5-7-9-11-27-41-34-22-17-30(18-23-34)31-19-24-35(25-20-31)42-38(40)33-21-26-36(37(39)28-33)32-15-13-29(14-16-32)12-10-8-6-4-2/h13-26,28H,3-12,27H2,1-2H3