2-benzo[e][1]benzofuran-1-yl-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]ethanamide

Systemtic Name: 2-benzo[e][1]benzofuran-1-yl-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]ethanamide Openeye Name: 2-benzo[e]benzofuran-1-yl-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]acetamide CAS Name: 2-(1-benzo[e]benzofuranyl)-N-[2-(4-morpholin-4-iumylmethyl)-4-quinazolinyl]acetamide IUPAC Name: 2-benzo[e][1]benzofuran-1-yl-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]acetamide Traditional Name: 2-benzo[e]benzofuran-1-yl-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]acetamide Formula: C27H25N4O3+ MolecularWeight: 453.5124

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=N2)NC(=O)CC4=COC5=C4C6=CC=CC=C6C=C5

Isomeric SMILES

C1COCC[NH+]1CC2=NC3=CC=CC=C3C(=N2)NC(=O)CC4=COC5=C4C6=CC=CC=C6C=C5

InChI

InChI=1S/C27H24N4O3/c32-25(15-19-17-34-23-10-9-18-5-1-2-6-20(18)26(19)23)30-27-21-7-3-4-8-22(21)28-24(29-27)16-31-11-13-33-14-12-31/h1-10,17H,11-16H2,(H,28,29,30,32)/p+1