[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl-diethyl-azanium

Systemtic Name: [3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl-diethyl-azanium Openeye Name: [3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]methyl-diethyl-ammonium CAS Name: [3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]methyl-diethylammonium IUPAC Name: [3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]methyl-diethylazanium Traditional Name: diethyl-[(4-keto-3-p-phenetyl-quinazolin-2-yl)methyl]ammonium Formula: C21H26N3O2+ MolecularWeight: 352.45004

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC

Isomeric SMILES

CC[NH+](CC)CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC

InChI

InChI=1S/C21H25N3O2/c1-4-23(5-2)15-20-22-19-10-8-7-9-18(19)21(25)24(20)16-11-13-17(14-12-16)26-6-3/h7-14H,4-6,15H2,1-3H3/p+1