[2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate

Systemtic Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate Openeye Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxo-ethyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(7-ethyl-1H-indol-3-yl)-2-oxoethyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-(7-ethyl-1H-indol-3-yl)-2-keto-ethyl] ester Formula: C18H23NO3 MolecularWeight: 301.38012

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CC(C)(C)C

Isomeric SMILES

CCC1=CC=CC2=C1NC=C2C(=O)COC(=O)CC(C)(C)C

InChI

InChI=1S/C18H23NO3/c1-5-12-7-6-8-13-14(10-19-17(12)13)15(20)11-22-16(21)9-18(2,3)4/h6-8,10,19H,5,9,11H2,1-4H3