6-methyl-3-(4-methylphenyl)-1-prop-2-ynyl-4H-quinazolin-1-ium bromide

Systemtic Name: 6-methyl-3-(4-methylphenyl)-1-prop-2-ynyl-4H-quinazolin-1-ium bromide Openeye Name: 6-methyl-1-prop-2-ynyl-3-(p-tolyl)-4H-quinazolin-1-ium bromide CAS Name: 6-methyl-3-(4-methylphenyl)-1-prop-2-ynyl-4H-quinazolin-1-ium bromide IUPAC Name: 6-methyl-3-(4-methylphenyl)-1-prop-2-ynyl-4H-quinazolin-1-ium bromide Traditional Name: 6-methyl-1-propargyl-3-(p-tolyl)-4H-quinazolin-1-ium bromide Formula: C19H19BrN2 MolecularWeight: 355.27156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC3=C(C=CC(=C3)C)[N+](=C2)CC#C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)N2CC3=C(C=CC(=C3)C)[N+](=C2)CC#C.[Br-]

InChI

InChI=1S/C19H19N2.BrH/c1-4-11-20-14-21(18-8-5-15(2)6-9-18)13-17-12-16(3)7-10-19(17)20;/h1,5-10,12,14H,11,13H2,2-3H3;1H/q+1;/p-1