N-methyl-2-(3-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)quinazolin-4-amine

Systemtic Name: N-methyl-2-(3-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)quinazolin-4-amine Openeye Name: N-methyl-N-(1-methylpiperidin-1-ium-4-yl)-2-(m-tolyl)quinazolin-4-amine CAS Name: N-methyl-2-(3-methylphenyl)-N-(1-methyl-4-piperidin-1-iumyl)-4-quinazolinamine IUPAC Name: N-methyl-2-(3-methylphenyl)-N-(1-methylpiperidin-1-ium-4-yl)quinazolin-4-amine Traditional Name: methyl-(1-methylpiperidin-1-ium-4-yl)-[2-(m-tolyl)quinazolin-4-yl]amine Formula: C22H27N4+ MolecularWeight: 347.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)N(C)C4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=N2)N(C)C4CC[NH+](CC4)C

InChI

InChI=1S/C22H26N4/c1-16-7-6-8-17(15-16)21-23-20-10-5-4-9-19(20)22(24-21)26(3)18-11-13-25(2)14-12-18/h4-10,15,18H,11-14H2,1-3H3/p+1