[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-iodanylbenzoate

Systemtic Name: [2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-iodanylbenzoate Openeye Name: [2-(3-methyl-1-piperidyl)-2-oxo-ethyl] 4-iodobenzoate CAS Name: 4-iodobenzoic acid [2-(3-methyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(3-methylpiperidin-1-yl)-2-oxoethyl] 4-iodobenzoate Traditional Name: 4-iodobenzoic acid [2-keto-2-(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=C(C=C2)I

Isomeric SMILES

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

InChI

InChI=1S/C15H18INO3/c1-11-3-2-8-17(9-11)14(18)10-20-15(19)12-4-6-13(16)7-5-12/h4-7,11H,2-3,8-10H2,1H3