1-ethyl-2-methyl-3-(3-methylphenyl)quinazolin-1-ium-4-one

Systemtic Name: 1-ethyl-2-methyl-3-(3-methylphenyl)quinazolin-1-ium-4-one Openeye Name: 1-ethyl-2-methyl-3-(m-tolyl)quinazolin-1-ium-4-one CAS Name: 1-ethyl-2-methyl-3-(3-methylphenyl)-4-quinazolin-1-iumone IUPAC Name: 1-ethyl-2-methyl-3-(3-methylphenyl)quinazolin-1-ium-4-one Traditional Name: 1-ethyl-2-methyl-3-(m-tolyl)quinazolin-1-ium-4-one Formula: C18H19N2O+ MolecularWeight: 279.35626

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C(N(C(=O)C2=CC=CC=C21)C3=CC=CC(=C3)C)C

Isomeric SMILES

CC[N+]1=C(N(C(=O)C2=CC=CC=C21)C3=CC=CC(=C3)C)C

InChI

InChI=1S/C18H19N2O/c1-4-19-14(3)20(15-9-7-8-13(2)12-15)18(21)16-10-5-6-11-17(16)19/h5-12H,4H2,1-3H3/q+1