5-(2-tert-butylphenoxy)carbonyl-3-oxidanyl-1,5-diphenyl-cyclohex-2-ene-1-carboxylate

Systemtic Name: 5-(2-tert-butylphenoxy)carbonyl-3-oxidanyl-1,5-diphenyl-cyclohex-2-ene-1-carboxylate Openeye Name: 5-(2-tert-butylphenoxy)carbonyl-3-hydroxy-1,5-diphenyl-cyclohex-2-ene-1-carboxylate CAS Name: 5-[(2-tert-butylphenoxy)-oxomethyl]-3-hydroxy-1,5-diphenyl-1-cyclohex-2-enecarboxylate IUPAC Name: 5-(2-tert-butylphenoxy)carbonyl-3-hydroxy-1,5-diphenylcyclohex-2-ene-1-carboxylate Traditional Name: 5-(2-tert-butylphenoxy)carbonyl-3-hydroxy-1,5-diphenyl-cyclohex-2-ene-1-carboxylate Formula: C30H29O5- MolecularWeight: 469.54826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OC(=O)C2(CC(=CC(C2)(C3=CC=CC=C3)C(=O)[O-])O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OC(=O)C2(CC(=CC(C2)(C3=CC=CC=C3)C(=O)[O-])O)C4=CC=CC=C4

InChI

InChI=1S/C30H30O5/c1-28(2,3)24-16-10-11-17-25(24)35-27(34)30(22-14-8-5-9-15-22)19-23(31)18-29(20-30,26(32)33)21-12-6-4-7-13-21/h4-18,31H,19-20H2,1-3H3,(H,32,33)/p-1