3-[[2-(4-methoxyphenyl)quinazolin-4-yl]amino]propyl-dimethyl-azanium

Systemtic Name: 3-[[2-(4-methoxyphenyl)quinazolin-4-yl]amino]propyl-dimethyl-azanium Openeye Name: 3-[[2-(4-methoxyphenyl)quinazolin-4-yl]amino]propyl-dimethyl-ammonium CAS Name: 3-[[2-(4-methoxyphenyl)-4-quinazolinyl]amino]propyl-dimethylammonium IUPAC Name: 3-[[2-(4-methoxyphenyl)quinazolin-4-yl]amino]propyl-dimethylazanium Traditional Name: 3-[[2-(4-methoxyphenyl)quinazolin-4-yl]amino]propyl-dimethyl-ammonium Formula: C20H25N4O+ MolecularWeight: 337.4387

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCCNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OC

Isomeric SMILES

C[NH+](C)CCCNC1=NC(=NC2=CC=CC=C21)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H24N4O/c1-24(2)14-6-13-21-20-17-7-4-5-8-18(17)22-19(23-20)15-9-11-16(25-3)12-10-15/h4-5,7-12H,6,13-14H2,1-3H3,(H,21,22,23)/p+1