3-chloranyl-5-(2,5-ditert-butyl-4-phenyl-phenyl)carbonyloxy-2-propyl-benzoic acid

Systemtic Name: 3-chloranyl-5-(2,5-ditert-butyl-4-phenyl-phenyl)carbonyloxy-2-propyl-benzoic acid Openeye Name: 3-chloro-5-(2,5-ditert-butyl-4-phenyl-benzoyl)oxy-2-propyl-benzoic acid CAS Name: 3-chloro-5-[(2,5-ditert-butyl-4-phenylphenyl)-oxomethoxy]-2-propylbenzoic acid IUPAC Name: 3-chloro-5-(2,5-ditert-butyl-4-phenylbenzoyl)oxy-2-propylbenzoic acid Traditional Name: 3-chloro-5-(2,5-ditert-butyl-4-phenyl-benzoyl)oxy-2-propyl-benzoic acid Formula: C31H35ClO4 MolecularWeight: 507.0602

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1C(=O)O)OC(=O)C2=C(C=C(C(=C2)C(C)(C)C)C3=CC=CC=C3)C(C)(C)C)Cl

Isomeric SMILES

CCCC1=C(C=C(C=C1C(=O)O)OC(=O)C2=C(C=C(C(=C2)C(C)(C)C)C3=CC=CC=C3)C(C)(C)C)Cl

InChI

InChI=1S/C31H35ClO4/c1-8-12-21-23(28(33)34)15-20(16-27(21)32)36-29(35)24-18-25(30(2,3)4)22(17-26(24)31(5,6)7)19-13-10-9-11-14-19/h9-11,13-18H,8,12H2,1-7H3,(H,33,34)