1-propanoyloxyethyl 4-[2-acetyloxy-2-oxidanylidene-1-(2-oxidanylidenepiperazin-1-yl)-1-phenoxy-ethyl]piperidine-1-carboxylate

Systemtic Name: 1-propanoyloxyethyl 4-[2-acetyloxy-2-oxidanylidene-1-(2-oxidanylidenepiperazin-1-yl)-1-phenoxy-ethyl]piperidine-1-carboxylate Openeye Name: 1-propanoyloxyethyl 4-[2-acetoxy-2-oxo-1-(2-oxopiperazin-1-yl)-1-phenoxy-ethyl]piperidine-1-carboxylate CAS Name: 4-[2-acetyloxy-2-oxo-1-(2-oxo-1-piperazinyl)-1-phenoxyethyl]-1-piperidinecarboxylic acid 1-(1-oxopropoxy)ethyl ester IUPAC Name: 1-propanoyloxyethyl 4-[2-acetyloxy-2-oxo-1-(2-oxopiperazin-1-yl)-1-phenoxyethyl]piperidine-1-carboxylate Traditional Name: 4-[2-acetoxy-2-keto-1-(2-ketopiperazino)-1-phenoxy-ethyl]piperidine-1-carboxylic acid 1-propionyloxyethyl ester Formula: C25H33N3O9 MolecularWeight: 519.54422

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC(C)OC(=O)N1CCC(CC1)C(C(=O)OC(=O)C)(N2CCNCC2=O)OC3=CC=CC=C3

Isomeric SMILES

CCC(=O)OC(C)OC(=O)N1CCC(CC1)C(C(=O)OC(=O)C)(N2CCNCC2=O)OC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O9/c1-4-22(31)35-18(3)36-24(33)27-13-10-19(11-14-27)25(23(32)34-17(2)29,28-15-12-26-16-21(28)30)37-20-8-6-5-7-9-20/h5-9,18-19,26H,4,10-16H2,1-3H3