2-oxidanylidenepentanedioic acid; 1,2,3,4-tetrahydroacridin-9-amine

Systemtic Name: 2-oxidanylidenepentanedioic acid; 1,2,3,4-tetrahydroacridin-9-amine Openeye Name: 2-oxopentanedioic acid; 1,2,3,4-tetrahydroacridin-9-amine CAS Name: 2-oxopentanedioic acid; 1,2,3,4-tetrahydroacridin-9-amine IUPAC Name: 2-oxopentanedioic acid; 1,2,3,4-tetrahydroacridin-9-amine Traditional Name: 2-ketoglutaric acid; 1,2,3,4-tetrahydroacridin-9-ylamine Formula: C18H20N2O5 MolecularWeight: 344.3618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=CC=CC=C3C(=C2C1)N.C(CC(=O)O)C(=O)C(=O)O

Isomeric SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)N.C(CC(=O)O)C(=O)C(=O)O

InChI

InChI=1S/C13H14N2.C5H6O5/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13;6-3(5(9)10)1-2-4(7)8/h1,3,5,7H,2,4,6,8H2,(H2,14,15);1-2H2,(H,7,8)(H,9,10)