[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-iodanylbenzoate

Systemtic Name: [2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-iodanylbenzoate Openeye Name: [2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl] 2-iodobenzoate CAS Name: 2-iodobenzoic acid [2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl] 2-iodobenzoate Traditional Name: 2-iodobenzoic acid [2-keto-2-[(3S)-3-methylpiperidino]ethyl] ester Formula: C15H18INO3 MolecularWeight: 387.21279

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)COC(=O)C2=CC=CC=C2I

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)COC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C15H18INO3/c1-11-5-4-8-17(9-11)14(18)10-20-15(19)12-6-2-3-7-13(12)16/h2-3,6-7,11H,4-5,8-10H2,1H3/t11-/m0/s1