methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]ammonium CAS Name: methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(4-oxo-1H-quinazolin-2-yl)methyl]azanium Traditional Name: benzyl-[(4-keto-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C17H18N3O+ MolecularWeight: 280.34432

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C17H17N3O/c1-20(11-13-7-3-2-4-8-13)12-16-18-15-10-6-5-9-14(15)17(21)19-16/h2-10H,11-12H2,1H3,(H,18,19,21)/p+1