[2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-(3,5-dimethyl-1-piperidyl)-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-(3,5-dimethyl-1-piperidinyl)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dimethylpiperidin-1-yl)-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-(3,5-dimethylpiperidino)-2-keto-ethyl] ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)COC(=O)C2=CC=C(C=C2)C#N)C

Isomeric SMILES

CC1CC(CN(C1)C(=O)COC(=O)C2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C17H20N2O3/c1-12-7-13(2)10-19(9-12)16(20)11-22-17(21)15-5-3-14(8-18)4-6-15/h3-6,12-13H,7,9-11H2,1-2H3