2-(3-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-amine

Systemtic Name: 2-(3-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-amine Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-2-(m-tolyl)quinazolin-4-amine CAS Name: 2-(3-methylphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-4-quinazolinamine IUPAC Name: 2-(3-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)quinazolin-4-amine Traditional Name: 3-morpholin-4-ium-4-ylpropyl-[2-(m-tolyl)quinazolin-4-yl]amine Formula: C22H27N4O+ MolecularWeight: 363.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C22H26N4O/c1-17-6-4-7-18(16-17)21-24-20-9-3-2-8-19(20)22(25-21)23-10-5-11-26-12-14-27-15-13-26/h2-4,6-9,16H,5,10-15H2,1H3,(H,23,24,25)/p+1