4-methoxy-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]benzamide

Systemtic Name: 4-methoxy-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]benzamide Openeye Name: 4-methoxy-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]benzamide CAS Name: 4-methoxy-N-[2-(4-morpholin-4-iumylmethyl)-4-quinazolinyl]benzamide IUPAC Name: 4-methoxy-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]benzamide Traditional Name: 4-methoxy-N-[2-(morpholin-4-ium-4-ylmethyl)quinazolin-4-yl]benzamide Formula: C21H23N4O3+ MolecularWeight: 379.43232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC2=NC(=NC3=CC=CC=C32)C[NH+]4CCOCC4

InChI

InChI=1S/C21H22N4O3/c1-27-16-8-6-15(7-9-16)21(26)24-20-17-4-2-3-5-18(17)22-19(23-20)14-25-10-12-28-13-11-25/h2-9H,10-14H2,1H3,(H,22,23,24,26)/p+1