ethanedioate; 1-methylpiperidin-2-one; hydrate

Systemtic Name: ethanedioate; 1-methylpiperidin-2-one; hydrate Openeye Name: 1-methylpiperidin-2-one; oxalate; hydrate CAS Name: 1-methyl-2-piperidinone; oxalate; hydrate IUPAC Name: 1-methylpiperidin-2-one; oxalate; hydrate Traditional Name: 1-methyl-2-piperidone; oxalate; hydrate Formula: C8H13NO6-2 MolecularWeight: 219.19192

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCCCC1=O.C(=O)(C(=O)[O-])[O-].O

Isomeric SMILES

CN1CCCCC1=O.C(=O)(C(=O)[O-])[O-].O

InChI

InChI=1S/C6H11NO.C2H2O4.H2O/c1-7-5-3-2-4-6(7)8;3-1(4)2(5)6;/h2-5H2,1H3;(H,3,4)(H,5,6);1H2/p-2