2-(4-oxidanylidenequinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-oxidanylidenequinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(4-oxoquinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(4-oxo-3-quinazolinyl)-N-[[4-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-oxoquinazolin-3-yl)-N-[[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(4-ketoquinazolin-3-yl)-N-[4-(pyrrolidin-1-ium-1-ylmethyl)benzyl]acetamide Formula: C22H25N4O2+ MolecularWeight: 377.4595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)CN3C=NC4=CC=CC=C4C3=O

Isomeric SMILES

C1CC[NH+](C1)CC2=CC=C(C=C2)CNC(=O)CN3C=NC4=CC=CC=C4C3=O

InChI

InChI=1S/C22H24N4O2/c27-21(15-26-16-24-20-6-2-1-5-19(20)22(26)28)23-13-17-7-9-18(10-8-17)14-25-11-3-4-12-25/h1-2,5-10,16H,3-4,11-15H2,(H,23,27)/p+1