2-[2,4-bis(oxidanylidene)-3-(phenylmethyl)quinazolin-1-yl]ethyl-diethyl-azanium

Systemtic Name: 2-[2,4-bis(oxidanylidene)-3-(phenylmethyl)quinazolin-1-yl]ethyl-diethyl-azanium Openeye Name: 2-(3-benzyl-2,4-dioxo-quinazolin-1-yl)ethyl-diethyl-ammonium CAS Name: 2-[2,4-dioxo-3-(phenylmethyl)-1-quinazolinyl]ethyl-diethylammonium IUPAC Name: 2-(3-benzyl-2,4-dioxoquinazolin-1-yl)ethyl-diethylazanium Traditional Name: 2-(3-benzyl-2,4-diketo-quinazolin-1-yl)ethyl-diethyl-ammonium Formula: C21H26N3O2+ MolecularWeight: 352.45004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCN1C2=CC=CC=C2C(=O)N(C1=O)CC3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCN1C2=CC=CC=C2C(=O)N(C1=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H25N3O2/c1-3-22(4-2)14-15-23-19-13-9-8-12-18(19)20(25)24(21(23)26)16-17-10-6-5-7-11-17/h5-13H,3-4,14-16H2,1-2H3/p+1