diethyl-[2-(4-oxidanylidenequinazolin-3-yl)ethyl]-(phenylmethyl)azanium

Systemtic Name: diethyl-[2-(4-oxidanylidenequinazolin-3-yl)ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-diethyl-[2-(4-oxoquinazolin-3-yl)ethyl]ammonium CAS Name: diethyl-[2-(4-oxo-3-quinazolinyl)ethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-diethyl-[2-(4-oxoquinazolin-3-yl)ethyl]azanium Traditional Name: benzyl-diethyl-[2-(4-ketoquinazolin-3-yl)ethyl]ammonium Formula: C21H26N3O+ MolecularWeight: 336.45064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CCN1C=NC2=CC=CC=C2C1=O)CC3=CC=CC=C3

Isomeric SMILES

CC[N+](CC)(CCN1C=NC2=CC=CC=C2C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H26N3O/c1-3-24(4-2,16-18-10-6-5-7-11-18)15-14-23-17-22-20-13-9-8-12-19(20)21(23)25/h5-13,17H,3-4,14-16H2,1-2H3/q+1