phenyl 2-chloranyl-4-(4-decoxyphenyl)benzoate

Systemtic Name: phenyl 2-chloranyl-4-(4-decoxyphenyl)benzoate Openeye Name: phenyl 2-chloro-4-(4-decoxyphenyl)benzoate CAS Name: 2-chloro-4-(4-decoxyphenyl)benzoic acid phenyl ester IUPAC Name: phenyl 2-chloro-4-(4-decoxyphenyl)benzoate Traditional Name: 2-chloro-4-(4-decoxyphenyl)benzoic acid phenyl ester Formula: C29H33ClO3 MolecularWeight: 465.02352

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=CC=C3)Cl

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC(=C(C=C2)C(=O)OC3=CC=CC=C3)Cl

InChI

InChI=1S/C29H33ClO3/c1-2-3-4-5-6-7-8-12-21-32-25-18-15-23(16-19-25)24-17-20-27(28(30)22-24)29(31)33-26-13-10-9-11-14-26/h9-11,13-20,22H,2-8,12,21H2,1H3