2-[3-(1,3-benzodioxol-5-ylmethyl)-2,4-bis(oxidanylidene)quinazolin-1-yl]-N-phenethyl-ethanamide

Systemtic Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2,4-bis(oxidanylidene)quinazolin-1-yl]-N-phenethyl-ethanamide Openeye Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2,4-dioxo-quinazolin-1-yl]-N-phenethyl-acetamide CAS Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2,4-dioxo-1-quinazolinyl]-N-phenethylacetamide IUPAC Name: 2-[3-(1,3-benzodioxol-5-ylmethyl)-2,4-dioxoquinazolin-1-yl]-N-phenethylacetamide Traditional Name: 2-(2,4-diketo-3-piperonyl-quinazolin-1-yl)-N-phenethyl-acetamide Formula: C26H23N3O5 MolecularWeight: 457.47792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4N(C3=O)CC(=O)NCCC5=CC=CC=C5

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=CC=CC=C4N(C3=O)CC(=O)NCCC5=CC=CC=C5

InChI

InChI=1S/C26H23N3O5/c30-24(27-13-12-18-6-2-1-3-7-18)16-28-21-9-5-4-8-20(21)25(31)29(26(28)32)15-19-10-11-22-23(14-19)34-17-33-22/h1-11,14H,12-13,15-17H2,(H,27,30)