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

Systemtic Name: 2-[5-tert-butyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-tert-butyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-tert-butyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-tert-butyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-tert-butyl-2-(3-phenoxyphenyl)-1H-indol-3-yl]acetic acid Formula: C26H25NO3 MolecularWeight: 399.4816

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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=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC2=C(C=C1)NC(=C2CC(=O)O)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C26H25NO3/c1-26(2,3)18-12-13-23-21(15-18)22(16-24(28)29)25(27-23)17-8-7-11-20(14-17)30-19-9-5-4-6-10-19/h4-15,27H,16H2,1-3H3,(H,28,29)