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

Systemtic Name: 2-[5-tert-butyl-2-(2-phenylmethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(2-benzyloxyphenyl)-5-tert-butyl-1H-indol-3-yl]acetic acid CAS Name: 2-[5-tert-butyl-2-(2-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-tert-butyl-2-(2-phenylmethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(2-benzoxyphenyl)-5-tert-butyl-1H-indol-3-yl]acetic acid Formula: C27H27NO3 MolecularWeight: 413.50818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C27H27NO3/c1-27(2,3)19-13-14-23-21(15-19)22(16-25(29)30)26(28-23)20-11-7-8-12-24(20)31-17-18-9-5-4-6-10-18/h4-15,28H,16-17H2,1-3H3,(H,29,30)