2-[5-tert-butyl-2-(4-methylphenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[5-tert-butyl-2-(4-methylphenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[5-tert-butyl-2-(p-tolyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[5-tert-butyl-2-(4-methylphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[5-tert-butyl-2-(4-methylphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[5-tert-butyl-2-(p-tolyl)-1H-indol-3-yl]acetic acid Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23NO2/c1-13-5-7-14(8-6-13)20-17(12-19(23)24)16-11-15(21(2,3)4)9-10-18(16)22-20/h5-11,22H,12H2,1-4H3,(H,23,24)