2-methylbutyl 2-chloranyl-4-[4-(4-decoxyphenyl)phenyl]carbonyloxy-benzoate

Systemtic Name: 2-methylbutyl 2-chloranyl-4-[4-(4-decoxyphenyl)phenyl]carbonyloxy-benzoate Openeye Name: 2-methylbutyl 2-chloro-4-[4-(4-decoxyphenyl)benzoyl]oxy-benzoate CAS Name: 2-chloro-4-[[4-(4-decoxyphenyl)phenyl]-oxomethoxy]benzoic acid 2-methylbutyl ester IUPAC Name: 2-methylbutyl 2-chloro-4-[4-(4-decoxyphenyl)benzoyl]oxybenzoate Traditional Name: 2-chloro-4-[4-(4-decoxyphenyl)benzoyl]oxy-benzoic acid 2-methylbutyl ester Formula: C35H43ClO5 MolecularWeight: 579.16592

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C35H43ClO5/c1-4-6-7-8-9-10-11-12-23-39-30-19-17-28(18-20-30)27-13-15-29(16-14-27)34(37)41-31-21-22-32(33(36)24-31)35(38)40-25-26(3)5-2/h13-22,24,26H,4-12,23,25H2,1-3H3