2-(4-dimethylaminophenyl)-1-methyl-3H-quinazolin-1-ium-4-one

Systemtic Name: 2-(4-dimethylaminophenyl)-1-methyl-3H-quinazolin-1-ium-4-one Openeye Name: 2-(4-dimethylaminophenyl)-1-methyl-3H-quinazolin-1-ium-4-one CAS Name: 2-(4-dimethylaminophenyl)-1-methyl-3H-quinazolin-1-ium-4-one IUPAC Name: 2-(4-dimethylaminophenyl)-1-methyl-3H-quinazolin-1-ium-4-one Traditional Name: 2-(4-dimethylaminophenyl)-1-methyl-3H-quinazolin-1-ium-4-one Formula: C17H18N3O+ MolecularWeight: 280.34432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N3O/c1-19(2)13-10-8-12(9-11-13)16-18-17(21)14-6-4-5-7-15(14)20(16)3/h4-11H,1-3H3/p+1