4-[6-(4-nitrophenoxy)carbonyloxyhexylcarbamoyloxy]piperidine-1-carboxylic acid

Systemtic Name: 4-[6-(4-nitrophenoxy)carbonyloxyhexylcarbamoyloxy]piperidine-1-carboxylic acid Openeye Name: 4-[6-(4-nitrophenoxy)carbonyloxyhexylcarbamoyloxy]piperidine-1-carboxylic acid CAS Name: 4-[[6-[(4-nitrophenoxy)-oxomethoxy]hexylamino]-oxomethoxy]-1-piperidinecarboxylic acid IUPAC Name: 4-[6-(4-nitrophenoxy)carbonyloxyhexylcarbamoyloxy]piperidine-1-carboxylic acid Traditional Name: 4-[6-(4-nitrophenoxy)carbonyloxyhexylcarbamoyloxy]piperidine-1-carboxylic acid Formula: C20H27N3O9 MolecularWeight: 453.44308

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(=O)NCCCCCCOC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CN(CCC1OC(=O)NCCCCCCOC(=O)OC2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C20H27N3O9/c24-18(31-17-9-12-22(13-10-17)19(25)26)21-11-3-1-2-4-14-30-20(27)32-16-7-5-15(6-8-16)23(28)29/h5-8,17H,1-4,9-14H2,(H,21,24)(H,25,26)