[2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate

Systemtic Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-bromanylbenzoate Openeye Name: [2-(2,6-dimethyl-1-piperidyl)-2-oxo-ethyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [2-(2,6-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(2,6-dimethylpiperidin-1-yl)-2-oxoethyl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [2-(2,6-dimethylpiperidino)-2-keto-ethyl] ester Formula: C16H20BrNO3 MolecularWeight: 354.2389

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20BrNO3/c1-11-4-3-5-12(2)18(11)15(19)10-21-16(20)13-6-8-14(17)9-7-13/h6-9,11-12H,3-5,10H2,1-2H3