(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-(3-phenoxypropyl)azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-(3-phenoxypropyl)azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-(3-phenoxypropyl)ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-(3-phenoxypropyl)ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-(3-phenoxypropyl)azanium Traditional Name: ethyl-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]-(3-phenoxypropyl)ammonium Formula: C22H28N3O4+ MolecularWeight: 398.47542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4/c1-4-25(11-8-12-29-16-9-6-5-7-10-16)15-21-23-18-14-20(28-3)19(27-2)13-17(18)22(26)24-21/h5-7,9-10,13-14H,4,8,11-12,15H2,1-3H3,(H,23,24,26)/p+1