N-(3H-1,2-benzodioxol-7-yl)-6-methoxy-7-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]quinazolin-4-amine

Systemtic Name: N-(3H-1,2-benzodioxol-7-yl)-6-methoxy-7-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]quinazolin-4-amine Openeye Name: N-(3H-1,2-benzodioxol-7-yl)-6-methoxy-7-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]quinazolin-4-amine CAS Name: N-(3H-1,2-benzodioxol-7-yl)-6-methoxy-7-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]-4-quinazolinamine IUPAC Name: N-(3H-1,2-benzodioxol-7-yl)-6-methoxy-7-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]quinazolin-4-amine Traditional Name: 3H-1,2-benzodioxol-7-yl-[6-methoxy-7-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]quinazolin-4-yl]amine Formula: C24H29N4O4+ MolecularWeight: 437.51146

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC=CC5=C4OOC5)OC

Isomeric SMILES

C[N+]1(CCCCC1)CCOC2=C(C=C3C(=C2)N=CN=C3NC4=CC=CC5=C4OOC5)OC

InChI

InChI=1S/C24H29N4O4/c1-28(9-4-3-5-10-28)11-12-30-22-14-20-18(13-21(22)29-2)24(26-16-25-20)27-19-8-6-7-17-15-31-32-23(17)19/h6-8,13-14,16H,3-5,9-12,15H2,1-2H3,(H,25,26,27)/q+1