2-(fluoranylmethyl)-3-(2-methylphenyl)-6-nitro-quinazolin-4-one

Systemtic Name: 2-(fluoranylmethyl)-3-(2-methylphenyl)-6-nitro-quinazolin-4-one Openeye Name: 2-(fluoromethyl)-6-nitro-3-(o-tolyl)quinazolin-4-one CAS Name: 2-(fluoromethyl)-3-(2-methylphenyl)-6-nitro-4-quinazolinone IUPAC Name: 2-(fluoromethyl)-3-(2-methylphenyl)-6-nitroquinazolin-4-one Traditional Name: 2-(fluoromethyl)-6-nitro-3-(o-tolyl)quinazolin-4-one Formula: C16H12FN3O3 MolecularWeight: 313.283183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CF

Isomeric SMILES

CC1=CC=CC=C1N2C(=NC3=C(C2=O)C=C(C=C3)[N+](=O)[O-])CF

InChI

InChI=1S/C16H12FN3O3/c1-10-4-2-3-5-14(10)19-15(9-17)18-13-7-6-11(20(22)23)8-12(13)16(19)21/h2-8H,9H2,1H3