N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-oxidanylidenecinnolin-1-yl)propanamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-oxocinnolin-1-yl)propanamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-oxo-1-cinnolinyl)propanamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-3-(4-oxocinnolin-1-yl)propanamide Traditional Name: N-homopiperonyl-3-(4-ketocinnolin-1-yl)propionamide Formula: C20H19N3O4 MolecularWeight: 365.38256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CCNC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CCNC(=O)CCN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C20H19N3O4/c24-17-12-22-23(16-4-2-1-3-15(16)17)10-8-20(25)21-9-7-14-5-6-18-19(11-14)27-13-26-18/h1-6,11-12H,7-10,13H2,(H,21,25)