4-[[(3-oxidanylidenespiro[2-benzofuran-1,4'-piperidine]-1'-yl)carbonylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[(3-oxidanylidenespiro[2-benzofuran-1,4'-piperidine]-1'-yl)carbonylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[(3-oxospiro[isobenzofuran-1,4'-piperidine]-1'-carbonyl)amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[oxo-(3-oxo-1'-spiro[isobenzofuran-1,4'-piperidine]yl)methyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[(3-oxospiro[2-benzofuran-1,4'-piperidine]-1'-carbonyl)amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[(3-ketospiro[phthalan-1,4'-piperidine]-1'-carbonyl)amino]methyl]cyclohexanecarboxylic acid Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CNC(=O)N2CCC3(CC2)C4=CC=CC=C4C(=O)O3)C(=O)O

Isomeric SMILES

C1CC(CCC1CNC(=O)N2CCC3(CC2)C4=CC=CC=C4C(=O)O3)C(=O)O

InChI

InChI=1S/C21H26N2O5/c24-18(25)15-7-5-14(6-8-15)13-22-20(27)23-11-9-21(10-12-23)17-4-2-1-3-16(17)19(26)28-21/h1-4,14-15H,5-13H2,(H,22,27)(H,24,25)