6,7-dimethoxy-2-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-2-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-2-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[[4-(3-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-2-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[[4-(3-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Formula: C22H27N4O4+ MolecularWeight: 411.47418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

Isomeric SMILES

COC1=CC=CC(=C1)N2CC[NH+](CC2)CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

InChI

InChI=1S/C22H26N4O4/c1-28-16-6-4-5-15(11-16)26-9-7-25(8-10-26)14-21-23-18-13-20(30-3)19(29-2)12-17(18)22(27)24-21/h4-6,11-13H,7-10,14H2,1-3H3,(H,23,24,27)/p+1