N4,N4-dimethyl-N1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]benzene-1,4-diamine

Systemtic Name: N4,N4-dimethyl-N1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]benzene-1,4-diamine Openeye Name: N4,N4-dimethyl-N1-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]benzene-1,4-diamine CAS Name: N4,N4-dimethyl-N1-[2-(1-pyrrolidin-1-iumylmethyl)-4-quinazolinyl]benzene-1,4-diamine IUPAC Name: 4-N,4-N-dimethyl-1-N-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]benzene-1,4-diamine Traditional Name: dimethyl-[4-[[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]amino]phenyl]amine Formula: C21H26N5+ MolecularWeight: 348.46464

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C[NH+]4CCCC4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)C[NH+]4CCCC4

InChI

InChI=1S/C21H25N5/c1-25(2)17-11-9-16(10-12-17)22-21-18-7-3-4-8-19(18)23-20(24-21)15-26-13-5-6-14-26/h3-4,7-12H,5-6,13-15H2,1-2H3,(H,22,23,24)/p+1