2-[4-[1-(2,2-dimethylpropanoyloxymethoxycarbonyl)piperidin-4-yl]-2-oxidanylidene-piperazin-1-yl]-3-oxidanylidene-2-phenoxy-butanoic acid

Systemtic Name: 2-[4-[1-(2,2-dimethylpropanoyloxymethoxycarbonyl)piperidin-4-yl]-2-oxidanylidene-piperazin-1-yl]-3-oxidanylidene-2-phenoxy-butanoic acid Openeye Name: 2-[4-[1-(2,2-dimethylpropanoyloxymethoxycarbonyl)-4-piperidyl]-2-oxo-piperazin-1-yl]-3-oxo-2-phenoxy-butanoic acid CAS Name: 2-[4-[1-[(2,2-dimethyl-1-oxopropoxy)methoxy-oxomethyl]-4-piperidinyl]-2-oxo-1-piperazinyl]-3-oxo-2-phenoxybutanoic acid IUPAC Name: 2-[4-[1-(2,2-dimethylpropanoyloxymethoxycarbonyl)piperidin-4-yl]-2-oxopiperazin-1-yl]-3-oxo-2-phenoxybutanoic acid Traditional Name: 3-keto-2-[2-keto-4-[1-(pivaloyloxymethoxycarbonyl)-4-piperidyl]piperazino]-2-phenoxy-butyric acid Formula: C26H35N3O9 MolecularWeight: 533.5708

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(C(=O)O)(N1CCN(CC1=O)C2CCN(CC2)C(=O)OCOC(=O)C(C)(C)C)OC3=CC=CC=C3

Isomeric SMILES

CC(=O)C(C(=O)O)(N1CCN(CC1=O)C2CCN(CC2)C(=O)OCOC(=O)C(C)(C)C)OC3=CC=CC=C3

InChI

InChI=1S/C26H35N3O9/c1-18(30)26(22(32)33,38-20-8-6-5-7-9-20)29-15-14-28(16-21(29)31)19-10-12-27(13-11-19)24(35)37-17-36-23(34)25(2,3)4/h5-9,19H,10-17H2,1-4H3,(H,32,33)