(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl-ethyl-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-(4-fluoroanilino)-2-oxo-ethyl]ammonium CAS Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-(4-fluoroanilino)-2-oxoethyl]ammonium IUPAC Name: (6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl-ethyl-[2-(4-fluoroanilino)-2-oxoethyl]azanium Traditional Name: ethyl-[2-(4-fluoroanilino)-2-keto-ethyl]-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]ammonium Formula: C21H24FN4O4+ MolecularWeight: 415.438063

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC[NH+](CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)CC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H23FN4O4/c1-4-26(12-20(27)23-14-7-5-13(22)6-8-14)11-19-24-16-10-18(30-3)17(29-2)9-15(16)21(28)25-19/h5-10H,4,11-12H2,1-3H3,(H,23,27)(H,24,25,28)/p+1