3-(4-fluorophenyl)-2-[(furan-2-ylmethylamino)methyl]-4aH-quinazolin-3-ium-4-one

Systemtic Name: 3-(4-fluorophenyl)-2-[(furan-2-ylmethylamino)methyl]-4aH-quinazolin-3-ium-4-one Openeye Name: 3-(4-fluorophenyl)-2-[(2-furylmethylamino)methyl]-4aH-quinazolin-3-ium-4-one CAS Name: 3-(4-fluorophenyl)-2-[(2-furanylmethylamino)methyl]-4aH-quinazolin-3-ium-4-one IUPAC Name: 3-(4-fluorophenyl)-2-[(furan-2-ylmethylamino)methyl]-4aH-quinazolin-3-ium-4-one Traditional Name: 3-(4-fluorophenyl)-2-[(2-furfurylamino)methyl]-4aH-quinazolin-3-ium-4-one Formula: C20H17FN3O2+ MolecularWeight: 350.366283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2C(=NC(=[N+](C2=O)C3=CC=C(C=C3)F)CNCC4=CC=CO4)C=C1

Isomeric SMILES

C1=CC2C(=NC(=[N+](C2=O)C3=CC=C(C=C3)F)CNCC4=CC=CO4)C=C1

InChI

InChI=1S/C20H17FN3O2/c21-14-7-9-15(10-8-14)24-19(13-22-12-16-4-3-11-26-16)23-18-6-2-1-5-17(18)20(24)25/h1-11,17,22H,12-13H2/q+1