4-[2-[[5-(4-methoxyphenyl)-8,8-dimethyl-7H-naphthalen-2-yl]selanyl]ethynyl]benzoic acid

Systemtic Name: 4-[2-[[5-(4-methoxyphenyl)-8,8-dimethyl-7H-naphthalen-2-yl]selanyl]ethynyl]benzoic acid Openeye Name: 4-[2-[[5-(4-methoxyphenyl)-8,8-dimethyl-7H-naphthalen-2-yl]selanyl]ethynyl]benzoic acid CAS Name: 4-[2-[[5-(4-methoxyphenyl)-8,8-dimethyl-7H-naphthalen-2-yl]seleno]ethynyl]benzoic acid IUPAC Name: 4-[2-[[5-(4-methoxyphenyl)-8,8-dimethyl-7H-naphthalen-2-yl]selanyl]ethynyl]benzoic acid Traditional Name: 4-[2-[[5-(4-methoxyphenyl)-8,8-dimethyl-7H-naphthalen-2-yl]seleno]ethynyl]benzoic acid Formula: C28H24O3Se MolecularWeight: 487.44836

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC=C(C2=C1C=C(C=C2)[Se]C#CC3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1(CC=C(C2=C1C=C(C=C2)[Se]C#CC3=CC=C(C=C3)C(=O)O)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C28H24O3Se/c1-28(2)16-14-24(20-8-10-22(31-3)11-9-20)25-13-12-23(18-26(25)28)32-17-15-19-4-6-21(7-5-19)27(29)30/h4-14,18H,16H2,1-3H3,(H,29,30)