(3-fluoranyl-4-methoxy-phenyl)methyl-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methyl]-methyl-azanium

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl-[[3-(furan-2-ylmethyl)-4-oxidanylidene-quinazolin-2-yl]methyl]-methyl-azanium Openeye Name: (3-fluoro-4-methoxy-phenyl)methyl-[[3-(2-furylmethyl)-4-oxo-quinazolin-2-yl]methyl]-methyl-ammonium CAS Name: (3-fluoro-4-methoxyphenyl)methyl-[[3-(2-furanylmethyl)-4-oxo-2-quinazolinyl]methyl]-methylammonium IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl-[[3-(furan-2-ylmethyl)-4-oxoquinazolin-2-yl]methyl]-methylazanium Traditional Name: (3-fluoro-4-methoxy-benzyl)-[[3-(2-furfuryl)-4-keto-quinazolin-2-yl]methyl]-methyl-ammonium Formula: C23H23FN3O3+ MolecularWeight: 408.445423

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC(=C(C=C1)OC)F)CC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

Isomeric SMILES

C[NH+](CC1=CC(=C(C=C1)OC)F)CC2=NC3=CC=CC=C3C(=O)N2CC4=CC=CO4

InChI

InChI=1S/C23H22FN3O3/c1-26(13-16-9-10-21(29-2)19(24)12-16)15-22-25-20-8-4-3-7-18(20)23(28)27(22)14-17-6-5-11-30-17/h3-12H,13-15H2,1-2H3/p+1