[(2S)-1-[(4-fluorophenyl)methyl]-4-oxidanylidene-2,3-dihydroquinazolin-2-yl]-methyl-azanium

Systemtic Name: [(2S)-1-[(4-fluorophenyl)methyl]-4-oxidanylidene-2,3-dihydroquinazolin-2-yl]-methyl-azanium Openeye Name: [(2S)-1-[(4-fluorophenyl)methyl]-4-oxo-2,3-dihydroquinazolin-2-yl]-methyl-ammonium CAS Name: [(2S)-1-[(4-fluorophenyl)methyl]-4-oxo-2,3-dihydroquinazolin-2-yl]-methylammonium IUPAC Name: [(2S)-1-[(4-fluorophenyl)methyl]-4-oxo-2,3-dihydroquinazolin-2-yl]-methylazanium Traditional Name: [(2S)-1-(4-fluorobenzyl)-4-keto-2,3-dihydroquinazolin-2-yl]-methyl-ammonium Formula: C16H17FN3O+ MolecularWeight: 286.324083

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Descriptors Computed from Structure

Canonical SMILES:

C[NH2+]C1NC(=O)C2=CC=CC=C2N1CC3=CC=C(C=C3)F

Isomeric SMILES

C[NH2+][C@@H]1NC(=O)C2=CC=CC=C2N1CC3=CC=C(C=C3)F

InChI

InChI=1S/C16H16FN3O/c1-18-16-19-15(21)13-4-2-3-5-14(13)20(16)10-11-6-8-12(17)9-7-11/h2-9,16,18H,10H2,1H3,(H,19,21)/p+1/t16-/m1/s1