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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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