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[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methyl-methyl-(2-phenoxyethyl)azanium

[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methyl-methyl-(2-phenoxyethyl)azanium

Systemtic Name:[6,8-bis(bromanyl)-4-oxidanylidene-1H-quinazolin-2-yl]methyl-methyl-(2-phenoxyethyl)azanium
Openeye Name:(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methyl-methyl-(2-phenoxyethyl)ammonium
CAS Name:(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methyl-methyl-(2-phenoxyethyl)ammonium
IUPAC Name:(6,8-dibromo-4-oxo-1H-quinazolin-2-yl)methyl-methyl-(2-phenoxyethyl)azanium
Traditional Name:(6,8-dibromo-4-keto-1H-quinazolin-2-yl)methyl-methyl-(2-phenoxyethyl)ammonium
Formula: C18H18Br2N3O2+
MolecularWeight: 468.16242
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC1=CC=CC=C1)CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br


Isomeric SMILES

C[NH+](CCOC1=CC=CC=C1)CC2=NC(=O)C3=CC(=CC(=C3N2)Br)Br


InChI

InChI=1S/C18H17Br2N3O2/c1-23(7-8-25-13-5-3-2-4-6-13)11-16-21-17-14(18(24)22-16)9-12(19)10-15(17)20/h2-6,9-10H,7-8,11H2,1H3,(H,21,22,24)/p+1


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