4-(hexylcarbamoyloxymethyl)-2-[(phenylmethyl)carbamoyloxy]piperidine-1-carboxylic acid

Systemtic Name: 4-(hexylcarbamoyloxymethyl)-2-[(phenylmethyl)carbamoyloxy]piperidine-1-carboxylic acid Openeye Name: 2-(benzylcarbamoyloxy)-4-(hexylcarbamoyloxymethyl)piperidine-1-carboxylic acid CAS Name: 4-[[(hexylamino)-oxomethoxy]methyl]-2-[oxo-[(phenylmethyl)amino]methoxy]-1-piperidinecarboxylic acid IUPAC Name: 2-(benzylcarbamoyloxy)-4-(hexylcarbamoyloxymethyl)piperidine-1-carboxylic acid Traditional Name: 2-(benzylcarbamoyloxy)-4-(hexylcarbamoyloxymethyl)piperidine-1-carboxylic acid Formula: C22H33N3O6 MolecularWeight: 435.51392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)OCC1CCN(C(C1)OC(=O)NCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCCCCCNC(=O)OCC1CCN(C(C1)OC(=O)NCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C22H33N3O6/c1-2-3-4-8-12-23-20(26)30-16-18-11-13-25(22(28)29)19(14-18)31-21(27)24-15-17-9-6-5-7-10-17/h5-7,9-10,18-19H,2-4,8,11-16H2,1H3,(H,23,26)(H,24,27)(H,28,29)