3-[[5-(aminomethyl)-2-fluoranyl-phenyl]methyl]quinazolin-4-one

Systemtic Name: 3-[[5-(aminomethyl)-2-fluoranyl-phenyl]methyl]quinazolin-4-one Openeye Name: 3-[[5-(aminomethyl)-2-fluoro-phenyl]methyl]quinazolin-4-one CAS Name: 3-[[5-(aminomethyl)-2-fluorophenyl]methyl]-4-quinazolinone IUPAC Name: 3-[[5-(aminomethyl)-2-fluorophenyl]methyl]quinazolin-4-one Traditional Name: 3-[5-(aminomethyl)-2-fluoro-benzyl]quinazolin-4-one Formula: C16H14FN3O MolecularWeight: 283.300263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC3=C(C=CC(=C3)CN)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC3=C(C=CC(=C3)CN)F

InChI

InChI=1S/C16H14FN3O/c17-14-6-5-11(8-18)7-12(14)9-20-10-19-15-4-2-1-3-13(15)16(20)21/h1-7,10H,8-9,18H2