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

Systemtic Name: 6,7-dimethoxy-2-[[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 6,7-dimethoxy-2-[[4-(o-tolylmethyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one CAS Name: 6,7-dimethoxy-2-[[4-[(2-methylphenyl)methyl]-1-piperazin-1-iumyl]methyl]-1H-quinazolin-4-one IUPAC Name: 6,7-dimethoxy-2-[[4-[(2-methylphenyl)methyl]piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Traditional Name: 6,7-dimethoxy-2-[[4-(2-methylbenzyl)piperazin-1-ium-1-yl]methyl]-1H-quinazolin-4-one Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CC[NH+](CC2)CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

Isomeric SMILES

CC1=CC=CC=C1CN2CC[NH+](CC2)CC3=NC(=O)C4=CC(=C(C=C4N3)OC)OC

InChI

InChI=1S/C23H28N4O3/c1-16-6-4-5-7-17(16)14-26-8-10-27(11-9-26)15-22-24-19-13-21(30-3)20(29-2)12-18(19)23(28)25-22/h4-7,12-13H,8-11,14-15H2,1-3H3,(H,24,25,28)/p+1