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

Systemtic Name: ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-[2-(4-propoxyphenoxy)ethyl]azanium Openeye Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[2-(4-propoxyphenoxy)ethyl]ammonium CAS Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[2-(4-propoxyphenoxy)ethyl]ammonium IUPAC Name: ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]-[2-(4-propoxyphenoxy)ethyl]azanium Traditional Name: ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]-[2-(4-propoxyphenoxy)ethyl]ammonium Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)OCC[NH+](CC)CC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CCCOC1=CC=C(C=C1)OCC[NH+](CC)CC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C22H27N3O3/c1-3-14-27-17-9-11-18(12-10-17)28-15-13-25(4-2)16-21-23-20-8-6-5-7-19(20)22(26)24-21/h5-12H,3-4,13-16H2,1-2H3,(H,23,24,26)/p+1