[2-chloranyl-4-(4-hexylphenyl)phenyl] 4-hexylbenzoate

Systemtic Name: [2-chloranyl-4-(4-hexylphenyl)phenyl] 4-hexylbenzoate Openeye Name: [2-chloro-4-(4-hexylphenyl)phenyl] 4-hexylbenzoate CAS Name: 4-hexylbenzoic acid [2-chloro-4-(4-hexylphenyl)phenyl] ester IUPAC Name: [2-chloro-4-(4-hexylphenyl)phenyl] 4-hexylbenzoate Traditional Name: 4-hexylbenzoic acid [2-chloro-4-(4-hexylphenyl)phenyl] ester Formula: C31H37ClO2 MolecularWeight: 477.07728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCC)Cl

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=CC(=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCC)Cl

InChI

InChI=1S/C31H37ClO2/c1-3-5-7-9-11-24-13-17-26(18-14-24)28-21-22-30(29(32)23-28)34-31(33)27-19-15-25(16-20-27)12-10-8-6-4-2/h13-23H,3-12H2,1-2H3