4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]quinazoline

Systemtic Name: 4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]quinazoline Openeye Name: 4-[4-(o-tolylmethyl)piperazin-4-ium-1-yl]quinazoline CAS Name: 4-[4-[(2-methylphenyl)methyl]-1-piperazin-4-iumyl]quinazoline IUPAC Name: 4-[4-[(2-methylphenyl)methyl]piperazin-4-ium-1-yl]quinazoline Traditional Name: 4-[4-(2-methylbenzyl)piperazin-4-ium-1-yl]quinazoline Formula: C20H23N4+ MolecularWeight: 319.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CCN(CC2)C3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C20H22N4/c1-16-6-2-3-7-17(16)14-23-10-12-24(13-11-23)20-18-8-4-5-9-19(18)21-15-22-20/h2-9,15H,10-14H2,1H3/p+1