3-(4-bromanyl-2-methyl-phenyl)-2-(fluoranylmethyl)-6-nitro-quinazolin-4-one

Systemtic Name: 3-(4-bromanyl-2-methyl-phenyl)-2-(fluoranylmethyl)-6-nitro-quinazolin-4-one Openeye Name: 3-(4-bromo-2-methyl-phenyl)-2-(fluoromethyl)-6-nitro-quinazolin-4-one CAS Name: 3-(4-bromo-2-methylphenyl)-2-(fluoromethyl)-6-nitro-4-quinazolinone IUPAC Name: 3-(4-bromo-2-methylphenyl)-2-(fluoromethyl)-6-nitroquinazolin-4-one Traditional Name: 3-(4-bromo-2-methyl-phenyl)-2-(fluoromethyl)-6-nitro-quinazolin-4-one Formula: C16H11BrFN3O3 MolecularWeight: 392.179243

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)N2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CF

Isomeric SMILES

CC1=C(C=CC(=C1)Br)N2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CF

InChI

InChI=1S/C16H11BrFN3O3/c1-9-6-10(17)2-5-14(9)20-15(8-18)19-13-4-3-11(21(23)24)7-12(13)16(20)22/h2-7H,8H2,1H3