[1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3,3-dimethylbutanoate

Systemtic Name: [1-(1H-indol-3-yl)-1-oxidanylidene-propan-2-yl] 3,3-dimethylbutanoate Openeye Name: [2-(1H-indol-3-yl)-1-methyl-2-oxo-ethyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [1-(1H-indol-3-yl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(1H-indol-3-yl)-1-oxopropan-2-yl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-(1H-indol-3-yl)-2-keto-1-methyl-ethyl] ester Formula: C17H21NO3 MolecularWeight: 287.35354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CC(C)(C)C

Isomeric SMILES

CC(C(=O)C1=CNC2=CC=CC=C21)OC(=O)CC(C)(C)C

InChI

InChI=1S/C17H21NO3/c1-11(21-15(19)9-17(2,3)4)16(20)13-10-18-14-8-6-5-7-12(13)14/h5-8,10-11,18H,9H2,1-4H3