(5-bromanyl-2-methoxy-phenyl)methyl-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-methyl-azanium

Systemtic Name: (5-bromanyl-2-methoxy-phenyl)methyl-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-methyl-azanium Openeye Name: (5-bromo-2-methoxy-phenyl)methyl-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-methyl-ammonium CAS Name: (5-bromo-2-methoxyphenyl)methyl-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-methylammonium IUPAC Name: (5-bromo-2-methoxyphenyl)methyl-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-methylazanium Traditional Name: (5-bromo-2-methoxy-benzyl)-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]-methyl-ammonium Formula: C20H23BrN3O4+ MolecularWeight: 449.31832

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC(=C1)Br)OC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

Isomeric SMILES

C[NH+](CC1=C(C=CC(=C1)Br)OC)CC2=NC(=O)C3=CC(=C(C=C3N2)OC)OC

InChI

InChI=1S/C20H22BrN3O4/c1-24(10-12-7-13(21)5-6-16(12)26-2)11-19-22-15-9-18(28-4)17(27-3)8-14(15)20(25)23-19/h5-9H,10-11H2,1-4H3,(H,22,23,25)/p+1