7-(2-azanylethyl)azepan-2-one; ethanedioic acid

Systemtic Name: 7-(2-azanylethyl)azepan-2-one; ethanedioic acid Openeye Name: 7-(2-aminoethyl)azepan-2-one; oxalic acid CAS Name: 7-(2-aminoethyl)-2-azepanone; oxalic acid IUPAC Name: 7-(2-aminoethyl)azepan-2-one; oxalic acid Traditional Name: 7-(2-aminoethyl)azepan-2-one; oxalic acid Formula: C10H18N2O5 MolecularWeight: 246.26032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)NC(C1)CCN.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCC(=O)NC(C1)CCN.C(=O)(C(=O)O)O

InChI

InChI=1S/C8H16N2O.C2H2O4/c9-6-5-7-3-1-2-4-8(11)10-7;3-1(4)2(5)6/h7H,1-6,9H2,(H,10,11);(H,3,4)(H,5,6)