2-[5-tert-butyl-2-(2,5-dimethylphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-tert-butyl-2-(2,5-dimethylphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-tert-butyl-2-(2,5-dimethylphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-tert-butyl-2-(2,5-dimethylphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-tert-butyl-2-(2,5-dimethylphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-tert-butyl-2-(2,5-dimethylphenyl)-1H-indol-3-yl]acetic acid Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C)CC(=O)O

InChI

InChI=1S/C22H25NO2/c1-13-6-7-14(2)16(10-13)21-18(12-20(24)25)17-11-15(22(3,4)5)8-9-19(17)23-21/h6-11,23H,12H2,1-5H3,(H,24,25)