4-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)phthalazin-1-amine

Systemtic Name: 4-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)phthalazin-1-amine Openeye Name: N-(3-morpholin-4-ium-4-ylpropyl)-4-(p-tolyl)phthalazin-1-amine CAS Name: 4-(4-methylphenyl)-N-[3-(4-morpholin-4-iumyl)propyl]-1-phthalazinamine IUPAC Name: 4-(4-methylphenyl)-N-(3-morpholin-4-ium-4-ylpropyl)phthalazin-1-amine Traditional Name: 3-morpholin-4-ium-4-ylpropyl-[4-(p-tolyl)phthalazin-1-yl]amine Formula: C22H27N4O+ MolecularWeight: 363.47598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCCC[NH+]4CCOCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)NCCC[NH+]4CCOCC4

InChI

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