5-piperidin-1-ylbenzene-1,3-dicarboxylate

Systemtic Name: 5-piperidin-1-ylbenzene-1,3-dicarboxylate Openeye Name: 5-(1-piperidyl)benzene-1,3-dicarboxylate CAS Name: 5-(1-piperidinyl)benzene-1,3-dicarboxylate IUPAC Name: 5-piperidin-1-ylbenzene-1,3-dicarboxylate Traditional Name: 5-piperidinoisophthalate Formula: C13H13NO4-2 MolecularWeight: 247.24662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=CC(=CC(=C2)C(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C13H15NO4/c15-12(16)9-6-10(13(17)18)8-11(7-9)14-4-2-1-3-5-14/h6-8H,1-5H2,(H,15,16)(H,17,18)/p-2