2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-[(5-methylfuran-2-yl)methyl]quinazolin-3-ium-4-amine

Systemtic Name: 2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-[(5-methylfuran-2-yl)methyl]quinazolin-3-ium-4-amine Openeye Name: 2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-[(5-methyl-2-furyl)methyl]quinazolin-3-ium-4-amine CAS Name: 2-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-N-[(5-methyl-2-furanyl)methyl]-4-quinazolin-3-iumamine IUPAC Name: 2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-N-[(5-methylfuran-2-yl)methyl]quinazolin-3-ium-4-amine Traditional Name: [2-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]quinazolin-3-ium-4-yl]-[(5-methyl-2-furyl)methyl]amine Formula: C26H31N5O2+2 MolecularWeight: 445.55664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=[NH+]C(=NC3=CC=CC=C32)C[NH+]4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC1=CC=C(O1)CNC2=[NH+]C(=NC3=CC=CC=C32)C[NH+]4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C26H29N5O2/c1-19-11-12-20(33-19)17-27-26-21-7-3-4-8-22(21)28-25(29-26)18-30-13-15-31(16-14-30)23-9-5-6-10-24(23)32-2/h3-12H,13-18H2,1-2H3,(H,27,28,29)/p+2