2-(4-methoxyphenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1H-quinazolin-4-one

Systemtic Name: 2-(4-methoxyphenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1H-quinazolin-4-one Openeye Name: 2-(4-methoxyphenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1H-quinazolin-4-one CAS Name: 2-(4-methoxyphenyl)-6-(4-methyl-1-piperazin-4-iumyl)-1H-quinazolin-4-one IUPAC Name: 2-(4-methoxyphenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1H-quinazolin-4-one Traditional Name: 2-(4-methoxyphenyl)-6-(4-methylpiperazin-4-ium-1-yl)-1H-quinazolin-4-one Formula: C20H23N4O2+ MolecularWeight: 351.42222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC3=C(C=C2)NC(=NC3=O)C4=CC=C(C=C4)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC3=C(C=C2)NC(=NC3=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C20H22N4O2/c1-23-9-11-24(12-10-23)15-5-8-18-17(13-15)20(25)22-19(21-18)14-3-6-16(26-2)7-4-14/h3-8,13H,9-12H2,1-2H3,(H,21,22,25)/p+1