2-[5-tert-butyl-2-(4-methylpyridin-2-yl)carbonyl-1H-indol-3-yl]ethanoate

Systemtic Name: 2-[5-tert-butyl-2-(4-methylpyridin-2-yl)carbonyl-1H-indol-3-yl]ethanoate Openeye Name: 2-[5-tert-butyl-2-(4-methylpyridine-2-carbonyl)-1H-indol-3-yl]acetate CAS Name: 2-[5-tert-butyl-2-[(4-methyl-2-pyridinyl)-oxomethyl]-1H-indol-3-yl]acetate IUPAC Name: 2-[5-tert-butyl-2-(4-methylpyridine-2-carbonyl)-1H-indol-3-yl]acetate Traditional Name: 2-[5-tert-butyl-2-(4-methylpicolinoyl)-1H-indol-3-yl]acetate Formula: C21H21N2O3- MolecularWeight: 349.40304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C(=O)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C)CC(=O)[O-]

Isomeric SMILES

CC1=CC(=NC=C1)C(=O)C2=C(C3=C(N2)C=CC(=C3)C(C)(C)C)CC(=O)[O-]

InChI

InChI=1S/C21H22N2O3/c1-12-7-8-22-17(9-12)20(26)19-15(11-18(24)25)14-10-13(21(2,3)4)5-6-16(14)23-19/h5-10,23H,11H2,1-4H3,(H,24,25)/p-1