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

Systemtic Name: 2-[5-tert-butyl-2-(3-ethoxyphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-tert-butyl-2-(3-ethoxyphenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-tert-butyl-2-(3-ethoxyphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-tert-butyl-2-(3-ethoxyphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-(5-tert-butyl-2-m-phenetyl-1H-indol-3-yl)acetic acid Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C)CC(=O)O

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C)CC(=O)O

InChI

InChI=1S/C22H25NO3/c1-5-26-16-8-6-7-14(11-16)21-18(13-20(24)25)17-12-15(22(2,3)4)9-10-19(17)23-21/h6-12,23H,5,13H2,1-4H3,(H,24,25)