[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 3-iodanylbenzoate

Systemtic Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 3-iodanylbenzoate Openeye Name: [2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl] 3-iodobenzoate CAS Name: 3-iodobenzoic acid [2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl] 3-iodobenzoate Traditional Name: 3-iodobenzoic acid [2-(2,6-dimethylpiperidino)-2-keto-ethyl] ester Formula: C16H20INO3 MolecularWeight: 401.23937

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1C(=O)COC(=O)C2=CC(=CC=C2)I)C

Isomeric SMILES

CC1CCCC(N1C(=O)COC(=O)C2=CC(=CC=C2)I)C

InChI

InChI=1S/C16H20INO3/c1-11-5-3-6-12(2)18(11)15(19)10-21-16(20)13-7-4-8-14(17)9-13/h4,7-9,11-12H,3,5-6,10H2,1-2H3