(2-oxidanylidene-2-piperidin-1-yl-ethyl) 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate

Systemtic Name: (2-oxidanylidene-2-piperidin-1-yl-ethyl) 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Openeye Name: [2-oxo-2-(1-piperidyl)ethyl] 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate CAS Name: 4,5-dimethoxy-2-[(2-methyl-1-oxopropyl)amino]benzoic acid [2-oxo-2-(1-piperidinyl)ethyl] ester IUPAC Name: (2-oxo-2-piperidin-1-ylethyl) 4,5-dimethoxy-2-(2-methylpropanoylamino)benzoate Traditional Name: 2-(isobutyrylamino)-4,5-dimethoxy-benzoic acid (2-keto-2-piperidino-ethyl) ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)N2CCCCC2)OC)OC

Isomeric SMILES

CC(C)C(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)N2CCCCC2)OC)OC

InChI

InChI=1S/C20H28N2O6/c1-13(2)19(24)21-15-11-17(27-4)16(26-3)10-14(15)20(25)28-12-18(23)22-8-6-5-7-9-22/h10-11,13H,5-9,12H2,1-4H3,(H,21,24)